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Pooja:2023:OSS% }. \NAMECITE{against}{% Efaz:2021:RFI,% Shekarappa:2023:DML,% Uddin:2023:LSP% }. \NAMECITE{agent}{% Sadhu:2020:PTC% }. \NAMECITE{agents}{% Ma:2023:RSC% }. \NAMECITE{aggregate}{% Rivera:2020:FLS% }. \NAMECITE{aggregates}{% Tirri:2021:CMC% }. \NAMECITE{Aggregation}{% Dey:2023:APP% }. \NAMECITE{agonist}{% Beck:2021:UIH% }. \NAMECITE{aided}{% Katsyuba:2022:CAS% }. \NAMECITE{Al}{% Anjali:2020:AEP% }. \NAMECITE{alanine}{% Dekany:2022:BIP,% Faizan:2023:ABA% }. \NAMECITE{{albicans}}{% Zhou:2022:TMP% }. \NAMECITE{Alchemical}{% Tanida:2020:AFE,% Wieder:2022:AFE,% Brankin:2022:PAR,% Gomez:2021:LAF,% Hayes:2021:SPG,% Minh:2020:AGD% }. \NAMECITE{alcohols}{% Zhang:2022:TCS% }. \NAMECITE{{Alder}}{% Mancera:2020:DAR,% Merzoud:2021:UID,% Nacereddine:2021:CIS,% Spotte-Smith:2020:ADA% }. \NAMECITE{aldimines}{% Benchehaima:2022:NOP% }. \NAMECITE{aldol}{% Li:2022:BCM% }. \NAMECITE{AlGDock}{% Minh:2020:AGD% }. \NAMECITE{algebra}{% Garcia-Jacas:2020:DMQ% }. \NAMECITE{algebraic}{% Hoffmann:2021:DES% }. \NAMECITE{Algorithm}{% Andoh:2021:AMM,% Wan:2020:DCG,% Flachsenberg:2021:LOS,% Goncalves:2022:SPT,% Jung:2021:NPC,% Khire:2023:DTA,% Lourenco:2023:GGA,% Mrovec:2021:DFO,% Prentis:2022:MEA,% Roussey:2023:QQS,% Sahin:2020:NHM% }. \NAMECITE{algorithms}{% Chevreau:2023:PIP,% Gangopadhyay:2021:ANP,% Pechlaner:2021:UMT,% Rezende:2023:ABG,% Zhao:2023:GSA% }. \NAMECITE{alignment}{% Simko:2022:QCP% }. \NAMECITE{alkali}{% Jharapla:2021:CDS,% Orabi:2020:DPF,% Otlyotov:2023:GPT,% Ozen:2020:TSA,% Yashmin:2023:CNG% }. \NAMECITE{alkali-metal-like}{% Yashmin:2023:CNG% }. \NAMECITE{alkaline}{% Zhang:2022:ARM% }. \NAMECITE{alkanes}{% Pinto:2021:MCP% }. \NAMECITE{alkylated}{% Muthusivarajan:2020:RAR% }. \NAMECITE{alkylpyrroles}{% Zahn:2021:BDF% }. \NAMECITE{Alkyne}{% Wang:2020:MSE% }. \NAMECITE{Alkynes}{% Jiang:2020:MSU,% Tian:2020:MDM% }. \NAMECITE{All-atom}{% Panthi:2023:AAS,% Baba:2022:PSD,% Larsson:2020:MTC,% Waschenbach:2020:DEG% }. \NAMECITE{All-electron}{% Rolfes:2020:AES% }. \NAMECITE{all-metal}{% Martinez-Araya:2022:ASC% }. \NAMECITE{all-purpose}{% Marti:2021:QQA% }. \NAMECITE{Allosteric}{% Botello-Smith:2020:IPP,% Chan:2021:MSM% }. \NAMECITE{alloy}{% Rezende:2023:ABG% }. \NAMECITE{along}{% Campetella:2020:FEE,% Macedo:2022:PEC% }. \NAMECITE{alpha}{% Pinto:2021:MCP% }. \NAMECITE{alpha-amylase}{% Pinto:2021:MCP% }. \NAMECITE{alternative}{% Kotowski:2021:PEA% }. \NAMECITE{Aluminabenzene}{% Brzeski:2023:ABL% }. \NAMECITE{Aluminabenzene-based}{% Brzeski:2023:ABL% }. \NAMECITE{aluminum}{% Bae:2022:TDD,% Koput:2022:ICA% }. \NAMECITE{{AMgF}}{% Sousa:2020:ASS% }. \NAMECITE{amide}{% Cuesta:2021:CSR% }. \NAMECITE{amination}{% Dong:2022:PXB% }. \NAMECITE{amine}{% Cuesta:2021:CSR,% Hernandez:2020:AIM% }. \NAMECITE{amino}{% Chong:2023:ECA,% Hernandez-Rodriguez:2020:MSS,% Orabi:2020:DPF% }. \NAMECITE{aminoborane}{% Schneider:2023:QCR% }. \NAMECITE{aminotetrazole}{% Jharapla:2021:CDS% }. \NAMECITE{aminotransferase}{% Banik:2020:QMS% }. \NAMECITE{{AMK\_Mountain}}{% Zhang:2022:ARM% }. \NAMECITE{Ammonia}{% Malloum:2020:LSA,% Saputri:2020:CLA,% Yanez:2023:DAU% }. \NAMECITE{ammonium}{% Orabi:2020:DPF% }. \NAMECITE{{AMOEBA}}{% Arabzadeh:2022:HDL,% Pan:2020:TSF,% Walker:2022:AAP% }. \NAMECITE{among}{% Ding:2020:EEP,% Gomez:2021:LAF,% Kim:2023:BHA% }. \NAMECITE{Amorphous}{% Xu:2020:APN,% Hayashi:2023:PAD% }. \NAMECITE{amylase}{% Pinto:2021:MCP% }. \NAMECITE{amyloid}{% Byun:2023:CRK% }. \NAMECITE{analogs}{% Pomogaeva:2023:LAS,% Zhang:2022:RTR% }. \NAMECITE{analogues}{% Shen:2021:CCH% }. \NAMECITE{Analyses}{% Savoo:2020:ASA,% Alipour:2020:ABS,% Gorantla:2022:UHR,% Gorantla:2023:SBC,% Kelich:2023:BPS,% Poleto:2022:TEF,% Trepte:2021:PCD% }. \NAMECITE{Analysis}{% Aaroen:2021:PVA,% Alzahrani:2020:CAI,% Barletta:2022:ACC,% Kusumoto:2020:SIA,% Martinez-Araya:2021:DPR,% Martinez-Araya:2022:ASC,% Miyamoto:2020:SER,% Andersson:2021:PCC,% Bai:2022:SGS,% Bates:2021:CIB,% Chen:2021:CLS,% Chinnasamy:2020:IBM,% Ciancaleoni:2020:DOH,% Devi:2022:ENA,% Dong:2022:PXB,% 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\NAMECITE{anharmonic}{% Ebisawa:2021:GAA% }. \NAMECITE{{ANI}}{% Temel:2023:PAM% }. \NAMECITE{{ANI-ML}}{% Temel:2023:PAM% }. \NAMECITE{aniline}{% Hidalgo-Rosa:2020:SME% }. \NAMECITE{Anion}{% Lin:2020:IMC,% Fan:2023:SSP,% Gresh:2021:MCP,% Xie:2020:SMP% }. \NAMECITE{anion-}{% Fan:2023:SSP% }. \NAMECITE{Anion-Ring}{% Lin:2020:IMC% }. \NAMECITE{Anionic}{% Alipour:2020:ABS,% Pant:2020:MCG,% Kumar:2023:BPS% }. \NAMECITE{anions}{% Brzeski:2023:ABL,% Gui:2021:ELM,% Tzeli:2021:QCB% }. \NAMECITE{Anisotropic}{% Gangopadhyay:2021:ANP,% Zheng:2020:ACC,% Andoh:2020:EFM,% Bandyopadhyay:2023:MCG% }. \NAMECITE{anisotropy}{% Shaimardanov:2023:HAF% }. \NAMECITE{annulene}{% Palmeiro:2021:EM% }. \NAMECITE{{AnO}}{% Lu:2023:HOS% }. \NAMECITE{anode}{% Sosa:2020:ELE% }. \NAMECITE{anomaly}{% Xu:2020:RPA% }. \NAMECITE{antagonists}{% Choudhuri:2020:SBB% }. \NAMECITE{anthracene}{% Mancera:2020:DAR% }. \NAMECITE{Anti}{% Kusumoto:2020:SIA,% Novak:2023:DCD,% Scoditti:2021:IEL% }. \NAMECITE{anti-cancer}{% Scoditti:2021:IEL% }. \NAMECITE{anti-{HIV}}{% Novak:2023:DCD% }. \NAMECITE{Anti-Human}{% Kusumoto:2020:SIA% }. \NAMECITE{antibiotic}{% Brankin:2022:PAR% }. \NAMECITE{Antibodies}{% Kusumoto:2020:SIA% }. \NAMECITE{anticancer}{% Hirakawa:2020:BME% }. \NAMECITE{antiferromagnetic}{% Wang:2023:CGC% }. \NAMECITE{antimicrobial}{% Saleh:2021:NHD% }. \NAMECITE{antimony}{% Pomogaeva:2021:ISL% }. \NAMECITE{antiporter}{% Wang:2020:LCD% }. \NAMECITE{antipsychotic}{% delCastillo:2021:IGA% }. \NAMECITE{antitumor}{% Pakdel:2020:ESA% }. \NAMECITE{any}{% delCastillo:2021:IGA% }. \NAMECITE{applicability}{% Gallmetzer:2022:PRA,% Lee:2023:BAM% }. \NAMECITE{Application}{% Garcia-Jacas:2020:SST,% Korsaye:2022:FDE,% Matyszczak:2021:AAN,% Pech:2020:QCT,% Tanida:2020:AFE,% Toutounji:2021:ESD,% Xie:2020:SMP,% Alaidi:2020:SMP,% Ma:2023:MLA,% Muz:2022:ZON,% Schmitz:2023:ARG,% Tripathy:2021:EEM,% Yang:2020:EME,% Yang:2020:ODP% }. \NAMECITE{Applications}{% Blasiak:2021:IEO,% Stuyver:2020:TCM,% Al-Qaisi:2023:TIL,% Cammi:2022:SDE,% Inamori:2020:SFA,% Izsak:2023:QCP,% Kar:2021:AFA,% Schaefer:2021:SCB,% Schuhmann:2021:IPM,% Shao:2021:LCA,% Tortorella:2021:CML% }. \NAMECITE{applied}{% Hirakawa:2020:BME,% Kaiser:2020:MCS,% Perron:2022:DGM% }. \NAMECITE{apply}{% Pechlaner:2021:MAB% }. \NAMECITE{Approach}{% Patel:2020:PPL,% Shepard:2020:RSG,% Stahl:2020:CAD,% Afonin:2022:GTC,% Afonin:2022:MTA,% Ammar:2021:CGA,% Aquino:2020:FON,% Chilkuri:2021:CMP,% Cocic:2022:IWS,% Douglas-Gallardo:2020:ESB,% Duzenli:2022:IGE,% Hoffmann:2020:PEE,% Inamori:2020:SFA,% Izsak:2023:QCP,% Jimenez-Gravalos:2021:CEH,% Khire:2023:DTA,% Kramer:2023:ESD,% Krog:2023:MCA,% Long:2022:ERP,% Lubecka:2022:CGA,% Luise:2022:MSP,% Maszota-Zieleniak:2021:ERE,% Mondal:2023:SSS,% Monti:2022:CAM,% Nguyen:2021:PLE,% Ootani:2020:TFM,% Patel:2020:DBL,% Rezende:2023:ABG,% Simm:2020:SMA,% Tehrani:2023:ITA,% Tirri:2021:CMC,% Tripathy:2021:EEM,% Vassetti:2020:ACS,% You:2023:EIM% }. \NAMECITE{approaches}{% Afonin:2020:QDR,% Gallmetzer:2022:PRA% }. \NAMECITE{approximate}{% Barcza:2022:CAI,% Jara-Cortes:2022:FAE% }. \NAMECITE{approximation}{% Brown:2021:MCP,% Cerezo:2023:FVR,% Minenkov:2023:ICB,% Najibi:2020:DDC,% Shiga:2022:PIB,% Vega:2020:GGA,% Yu:2020:DHD% }. \NAMECITE{Approximations}{% Haase:2020:NDC,% Bozkaya:2020:SAC,% Rayon:2022:ADF% }. \NAMECITE{aprotic}{% Otlyotov:2022:CEM% }. \NAMECITE{aptamer}{% Kalathingal:2023:MMB,% Tanida:2020:AFE% }. \NAMECITE{{AQUA}}{% Lian:2020:AMD% }. \NAMECITE{{AQUA-MER}}{% Lian:2020:AMD% }. \NAMECITE{aquation}{% Hirakawa:2020:BME% }. \NAMECITE{Aqueous}{% Spotte-Smith:2020:ADA,% Kido:2023:CHL,% Kurisaki:2023:TCC,% Lian:2020:AMD,% Panthi:2023:AAS,% Raucci:2020:IMD,% Vyboishchikov:2021:FNI,% Yadav:2020:THN% }. \NAMECITE{{Archive}}{% Riccardi:2022:TIF% }. \NAMECITE{Area}{% Gong:2020:AGB,% Vassetti:2020:ACS% }. \NAMECITE{Arene}{% Kar:2021:AFA% }. \NAMECITE{Argentophillic}{% Evarestov:2021:AIA% }. \NAMECITE{argentum}{% Evarestov:2021:AIA% }. \NAMECITE{argon}{% Nash:2023:CCA% }. \NAMECITE{{ARGOS}}{% 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\NAMECITE{Automatic}{% Semidalas:2022:AGC,% Fujimori:2021:EBA% }. \NAMECITE{Automation}{% Walker:2022:AAP% }. \NAMECITE{Automative}{% Schneider:2023:OSL% }. \NAMECITE{Automatized}{% Avagliano:2022:API,% Schmitz:2021:AWM% }. \NAMECITE{{AutoMeKin2021}}{% Martinez-Nunez:2021:AOS% }. \NAMECITE{auxetic}{% Morin-Martinez:2023:QBA% }. \NAMECITE{auxiliary}{% Medves:2022:ODF,% Nash:2023:CCA,% Semidalas:2022:AGC% }. \NAMECITE{available}{% Tchougreeff:2021:SSQ% }. \NAMECITE{averaged}{% Takaba:2022:PLB% }. \NAMECITE{Avoids}{% Sakae:2020:APB% }. \NAMECITE{aware}{% Tortorella:2021:CML% }. \NAMECITE{axial}{% Guan:2023:DMS,% Pagola:2023:ACL% }. \NAMECITE{{Aza-BODIPY}}{% Feldt:2021:ALC% }. \NAMECITE{azabenzenes}{% Bankiewicz:2021:TML% }. \NAMECITE{azide}{% Xu:2020:APN% }. \NAMECITE{Azobenzene}{% Ye:2020:FBS,% Yuan:2022:CSF% }. \NAMECITE{azobenzene-containing}{% Yuan:2022:CSF% }. \NAMECITE{{AzoChignolin}}{% Zschau:2023:MHF% }. \NAMECITE{azomethine}{% Sobhi:2023:UMR% }. \NAMECITE{B}{% Li:2021:TNS,% 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\NAMECITE{{Cassandra}}{% DeFever:2021:MCC% }. \NAMECITE{{CASSCF}}{% Lu:2023:HOS,% Stsiapura:2020:SEE% }. \NAMECITE{catalysis}{% Joseph:2020:MDA% }. \NAMECITE{catalyst}{% Chen:2021:CLS,% Martinez-Araya:2021:DPR% }. \NAMECITE{catalysts}{% Dong:2023:EZL,% Maley:2023:DFT,% Menzel:2021:EWI,% Sun:2023:RDI,% Wu:2023:DKS% }. \NAMECITE{catalytic}{% Chen:2021:CLS,% Chen:2023:DSC,% Dutta:2021:RDP,% Menzel:2021:EWI,% Pinto:2021:MCP,% Priyadarsini:2021:CFP,% Yang:2020:PCA,% Zhang:2021:CPC% }. \NAMECITE{Catalyzed}{% Li:2022:BCM,% Ali:2022:MSC,% Huang:2022:MSC,% Hussain:2020:IBT,% Nacereddine:2021:CIS,% Pakdel:2020:ESA% }. \NAMECITE{Cation}{% Lin:2020:IMC,% Koput:2022:GSP,% Orabi:2020:DPF,% Perumalla:2023:RDM,% Yashmin:2023:CNG,% deAraujo:2023:HCN% }. \NAMECITE{cationic}{% Kumar:2023:BPS% }. \NAMECITE{cations}{% Arrue:2021:SCB,% Jablonski:2022:EEC% }. \NAMECITE{{CATKINAS}}{% Chen:2021:CLS% }. \NAMECITE{caused}{% Lo:2023:USH% }. \NAMECITE{Cavity}{% Garcia-Rates:2020:ESC,% Barletta:2022:ACC,% Mondal:2023:SSS% }. \NAMECITE{{CBS}}{% Chen:2020:TLC,% Dorofeeva:2020:APN,% Smith:2020:KTR% }. \NAMECITE{CC3}{% Ghalami:2020:AST% }. \NAMECITE{CC3-R}{% Ghalami:2020:AST% }. \NAMECITE{{CCl}}{% Katsyuba:2022:CAS% }. \NAMECITE{{CCSD}}{% Chamkin:2020:DDC,% Chan:2022:ADC,% Chen:2020:TLC,% Dorofeeva:2020:APN,% Garcia-Rates:2021:ISD,% Khire:2023:DTA,% Maley:2023:DFT,% Matveeva:2022:EMF,% Minenkov:2023:ICB,% Paiva:2020:AVD,% Seeger:2022:DCB% }. \NAMECITE{{CCSDT}}{% Smith:2020:KTR% }. \NAMECITE{{Cd}}{% Jager:2021:VOP% }. \NAMECITE{{CdSe}}{% Luise:2021:MUV% }. \NAMECITE{Celebrating}{% Im:2020:CBR% }. \NAMECITE{cells}{% Andoh:2020:EFM,% Su:2020:IHH,% Taouali:2023:DFT% }. \NAMECITE{{CellSys}}{% Abbasi:2022:COS% }. \NAMECITE{cellulose}{% Lamine:2022:TER% }. \NAMECITE{center}{% Leskourova:2022:ECH% }. \NAMECITE{centered}{% Leskourova:2022:ECH% }. \NAMECITE{{CEPA/1}}{% Sanchez:2020:CIS% }. \NAMECITE{{CGeGaAl}}{% Das:2022:CCH% }. \NAMECITE{CH}{% Ali:2022:MSC,% Salta:2022:DCT,% deCarvalho:2020:VTS,% 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Chao:2021:IPN,% Lev:2020:SIC,% Xie:2020:SMP% }. \NAMECITE{channels}{% Ohno:2021:HPG% }. \NAMECITE{Chaperone}{% Verma:2020:MIS% }. \NAMECITE{character}{% Borocci:2020:CHN,% Luy:2023:BCI,% Sulka:2021:FNO% }. \NAMECITE{characteristics}{% Khakimov:2022:TTC,% Ma:2023:RSC% }. \NAMECITE{Characterization}{% Byun:2023:CRK,% Pant:2020:MCG,% deBeer:2020:CBM,% Gentile:2020:SCD,% Koput:2022:ICA,% Li:2023:FIS,% McCutcheon:2023:AMC,% Platonenko:2021:ICD,% Sorbelli:2022:ENB% }. \NAMECITE{characterize}{% Lefebvre:2023:IPI% }. \NAMECITE{Charge}{% Garcia-Rates:2020:ESC,% Stachowicz-Kusnierz:2020:CDM,% Blasiak:2021:IEO,% Bremond:2021:ACI,% Casanova-Paez:2021:GDH,% Ciancaleoni:2020:DOH,% Inoue:2023:RNC,% Iuchi:2021:MEH,% Kaiser:2020:MCS,% Nieuwland:2023:UCS,% Ohlknecht:2020:CEA,% Ottochian:2020:DHT,% Pan:2020:TSF,% Peng:2020:APR,% Saputri:2020:CLA,% Schmitt:2023:TEC,% Summa:2023:CFD,% Sun:2023:DTHb,% Xi:2021:TDS,% Zhang:2022:TCS,% Zheng:2020:ACC,% delCastillo:2021:IGA% }. \NAMECITE{charge-scaling}{% Zhang:2022:TCS% }. \NAMECITE{charge-transfer}{% Blasiak:2021:IEO,% Bremond:2021:ACI,% Iuchi:2021:MEH% }. \NAMECITE{charged}{% Hernandez:2020:AIM,% Shaimardanov:2023:HAF% }. \NAMECITE{charges}{% Chao:2021:IPN,% Leskourova:2022:ECH,% Nelson:2020:LLO% }. \NAMECITE{{Charm}}{% Wang:2020:PPC% }. \NAMECITE{{CHARMM}}{% Friis:2020:MEI,% Kognole:2022:PCG,% Kumar:2020:FSP,% Qi:2020:CGD,% Terteci-Popescu:2022:BPC,% Vankayala:2022:PCN% }. \NAMECITE{{CHARMM}-based}{% Vankayala:2022:PCN% }. \NAMECITE{{CHARMM-GUI}}{% Kognole:2022:PCG,% Qi:2020:CGD% }. \NAMECITE{Chem}{% Mahajan:2020:EMC,% Weinhold:2021:CSW,% Chirico:2021:PQC% }. \NAMECITE{{chemcoord}}{% Weser:2023:AHC% }. \NAMECITE{Chemical}{% Anders:2023:CBH,% Awoonor-Williams:2020:QCM,% Carreon-Gonzalez:2022:CRD,% Dare:2022:CRQ,% Martino:2020:CPE,% Ohno:2020:QCE,% Patel:2020:DCI,% Vijayalakshmi:2020:ECR,% Weinhold:2021:CSW,% Arrue:2021:SCB,% BenSaid:2021:ENS,% Benassi:2022:IDF,% Brabec:2021:MPQ,% Cao:2023:ESP,% Chevreau:2023:PIP,% Chirico:2021:PQC,% Ciancaleoni:2020:DOH,% Douglas-Gallardo:2020:ESB,% Evarestov:2020:TAC,% Hu:2020:RFM,% Klein:2021:NIC,% Kong:2022:MPR,% Levina:2023:DPC,% Lu:2022:IGM,% Ma:2023:MLA,% Macedo:2022:PEC,% Mandal:2020:ECF,% Martinez-Araya:2022:ASC,% Mifkovic:2022:CPP,% Nelson:2020:LLO,% Ohno:2021:HPG,% Pech:2020:QCT,% Pilme:2020:QCT,% Ramos-Sanchez:2023:AMG,% Salgado-Blanco:2023:EMP,% Schaefer:2021:SCB,% Schmitz:2021:AWM,% Schneider:2023:OSL,% Schneider:2023:QCR,% Simko:2022:QCP,% Taouali:2023:DFT,% Tupikina:2020:LPM,% Tzeli:2021:QCB,% Unzueta:2020:PCM,% Vornweg:2023:SCQ,% Wang:2021:RCS,% Wang:2021:SWD,% Weser:2023:AHC,% Yarish:2023:AMG,% Zahn:2021:BDF% }. \NAMECITE{chemical-bonding}{% Nelson:2020:LLO% }. \NAMECITE{chemically}{% Baba:2022:PSD,% Burn:2022:PCA,% Tortorella:2021:CML% }. \NAMECITE{chemicals}{% Chirico:2021:PQC,% Wassenaar:2022:ZST% }. \NAMECITE{{Chemisorption}}{% Popov:2021:LPP% }. \NAMECITE{chemistry}{% Brodney:2023:IDE,% DiGrande:2023:ATA,% Gresh:2021:MCP,% Kim:2023:FPL,% Lefrancois-Gagnon:2020:TUS,% Nieuwland:2023:UCS,% Prasanna:2021:DOS,% Sadhu:2020:PTC,% Sarkar:2023:GGA,% Segatta:2021:ISI,% Tchougreeff:2021:SSQ,% Tomecek:2023:ACC,% Tortorella:2021:CML,% Trepte:2022:DDC,% Tsuneda:2023:ROE,% Verstraelen:2021:IPL,% Xie:2023:KID% }. \NAMECITE{{Chignolin}}{% Zschau:2023:MHF% }. \NAMECITE{{ChimeraX}}{% Schaefer:2021:SCB% }. \NAMECITE{chiral}{% Garcia-Jacas:2020:DMQ,% Mancera:2020:DAR,% Pagola:2021:PAG,% Sahu:2021:ICT% }. \NAMECITE{chirality}{% Pagola:2023:ACL% }. \NAMECITE{chloride}{% Milovanovic:2021:SLC% }. \NAMECITE{choice}{% Speelman:2021:ECS% }. \NAMECITE{Cholesterol}{% Banavali:2020:MCM% }. \NAMECITE{chromophore}{% Raucci:2020:IMD% }. \NAMECITE{chromophores}{% Benchehaima:2022:NOP,% Monti:2022:CAM% }. \NAMECITE{{CI}}{% Chilkuri:2021:CMP,% Gieseking:2021:NRM% }. \NAMECITE{{CIFDock}}{% Vankayala:2022:PCN% }. \NAMECITE{circular}{% Monti:2022:CAM% }. \NAMECITE{Cis}{% Ye:2020:FBS% }. \NAMECITE{Cis-Azobenzene}{% Ye:2020:FBS% }. \NAMECITE{Cl}{% Simko:2022:QCP,% Zhang:2021:REF,% Ali:2023:SEM,% Ghalami:2020:AST,% Morera-Boado:2023:IEC,% Savoo:2020:ASA,% Wang:2020:LCD% }. \NAMECITE{{CL-20}}{% Zhang:2021:REF% }. \NAMECITE{{CL-20/HMX}}{% Zhang:2021:REF% }. \NAMECITE{{Clar}}{% Tolstykh:2022:UCA% }. \NAMECITE{classic}{% Martinez-Araya:2022:ASC% }. \NAMECITE{classical}{% Bates:2021:CIB,% Donyapour:2021:CPU,% Hayashi:2023:PAD,% Kognole:2022:PCG% }. \NAMECITE{{ClassicalGSG}}{% Donyapour:2021:CPU% }. \NAMECITE{classify}{% Doi:2021:SLO% }. \NAMECITE{clathrate}{% Valdes:2023:CCI% }. \NAMECITE{clathrate-hydrates}{% Valdes:2023:CCI% }. \NAMECITE{cleavage}{% Cuesta:2021:CSR,% Joseph:2020:MDA% }. \NAMECITE{close}{% Carreon-Gonzalez:2022:CRD% }. \NAMECITE{closed}{% Kloo:2022:CSI,% Mrovec:2021:DFO% }. \NAMECITE{closed-shell}{% Kloo:2022:CSI,% Mrovec:2021:DFO% }. \NAMECITE{Cluster}{% Bader:2020:VCM,% Wu:2020:DOC,% Benedek:2022:SCC,% Bozkaya:2020:SAC,% Dekany:2022:BIP,% Feldt:2021:ALC,% Garcia-Rates:2021:ISD,% Hutcheson:2021:DGE,% Kirschbaum:2022:EOA,% Nhat:2021:ALE,% Sarmah:2022:HSC,% Schwan:2023:IMC,% Simm:2020:SMA,% Waldrop:2020:ICC% }. \NAMECITE{cluster-continuum}{% Simm:2020:SMA% }. \NAMECITE{Clusters}{% Malloum:2020:LSA,% Ahirwar:2023:FFM,% Badalov:2020:PPG,% Castor-Villegas:2020:SHB,% Damte:2020:BCD,% Jager:2021:VOP,% Karachi:2023:BHS,% Karpov:2021:HSM,% Khire:2023:DTA,% Krog:2023:MCA,% Lai:2021:NGC,% Li:2023:SRE,% Liu:2022:GES,% Martinez-Araya:2022:ASC,% Milovanovic:2021:SLC,% Nair:2021:RAO,% Nguyen:2022:BCC,% Nhat:2020:EBM,% Otlyotov:2022:CEM,% Otlyotov:2023:GPT,% Piotrowski:2022:AVW,% Rezende:2023:ABG,% Tran:2020:ESN,% Tripathy:2021:EEM,% Valdes:2020:TSA,% Wang:2022:SEE,% Wang:2023:CGC,% Yanez:2023:DAU,% Zeng:2020:SNS% }. \NAMECITE{{Cm}}{% Lu:2023:HOS% }. \NAMECITE{CO}{% Parambath:2023:DQB,% Wang:2020:MSE,% Liu:2022:GES,% Damte:2020:BCD,% Gorantla:2023:SBC,% Mollahosseini:2022:EMI,% Ali:2022:MSC,% Ananthaneni:2020:CST,% Douglas-Gallardo:2020:ESB,% Faizan:2022:BBI,% Faizan:2023:ABA,% Freindorf:2022:CBH,% Li:2021:TNS,% Muz:2022:ZON,% Rayon:2022:ADF,% Schmitt:2023:TEC,% Sorbelli:2022:ENB,% Valdes:2023:CCI,% Waldrop:2020:ICC,% Xu:2022:EPH,% Yuan:2021:JDF% }. \NAMECITE{co-deposition}{% Mollahosseini:2022:EMI% }. \NAMECITE{co-factor}{% Gorantla:2023:SBC% }. \NAMECITE{{CO-N}}{% Xu:2022:EPH% }. \NAMECITE{Coarse}{% Mahajan:2020:EMC,% Wan:2020:DCG,% Wu:2020:DOC,% Bandyopadhyay:2023:MCG,% Cordina:2023:TMP,% Gangopadhyay:2021:ANP,% Kogut:2021:PCG,% Lubecka:2021:EAE,% Lubecka:2022:CGA,% Mahajan:2019:MCG,% Sieradzan:2023:OPI% }. \NAMECITE{Coarse-Grained}{% Mahajan:2020:EMC,% Wan:2020:DCG,% Wu:2020:DOC,% Bandyopadhyay:2023:MCG,% Cordina:2023:TMP,% Gangopadhyay:2021:ANP,% Kogut:2021:PCG,% Lubecka:2021:EAE,% Lubecka:2022:CGA,% Mahajan:2019:MCG,% Sieradzan:2023:OPI% }. \NAMECITE{cobalt}{% Huang:2022:MSC% }. \NAMECITE{{COBRAMM}}{% Avagliano:2022:API% }. \NAMECITE{cocrystal}{% Zhang:2021:REF% }. \NAMECITE{Code}{% Stuyver:2020:TCM,% Trepte:2021:PCD% }. \NAMECITE{codelivery}{% Pakdel:2020:ESA% }. \NAMECITE{codes}{% Wilson:2021:CMN% }. \NAMECITE{coefficient}{% Sun:2023:DTHa,% Usler:2023:GES% }. \NAMECITE{coefficients}{% Baba:2022:PSD% }. \NAMECITE{Coelenterazine}{% Griffiths:2020:AIP% }. \NAMECITE{Coenzyme}{% Cao:2020:DFS% }. \NAMECITE{{COF}}{% Yuan:2021:JDF% }. \NAMECITE{coherent}{% Eidi:2021:HOH% }. \NAMECITE{coinage}{% Felix:2023:MAC,% Munoz-Castro:2022:BCN% }. \NAMECITE{collision}{% Bai:2021:FRD% }. \NAMECITE{Colorings}{% Balasubramanian:2020:CCH% }. \NAMECITE{combination}{% Gupta:2022:EHD,% Kido:2023:CHL% }. \NAMECITE{Combined}{% Ramos:2021:DFF,% Andoh:2021:AMM,% Kramer:2023:ESD,% Luise:2022:MSP,% Tashiro:2021:NGO,% Tirri:2021:CMC,% Wu:2021:AHP% }. \NAMECITE{Combining}{% Brown:2021:MCP,% Menzel:2021:EWI,% Tortorella:2021:CML,% Wan:2020:DCG,% Kapakayala:2021:BCS,% Nikitin:2021:FCS% }. \NAMECITE{Comment}{% Mahajan:2021:CMF,% Nanayakkara:2021:CEN,% Wang:2023:CPL,% Weinhold:2021:CSW,% Casanova-Paez:2021:GDH,% Wang:2021:RCS% }. \NAMECITE{common}{% 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Zhang:2021:CPC,% Zhang:2021:RDN% }. \NAMECITE{complexation}{% Sadhu:2020:PTC% }. \NAMECITE{Complexes}{% Alzahrani:2020:CAI,% Borocci:2020:CHN,% Alberto:2020:ISP,% Anila:2023:FMS,% Anjali:2020:AEP,% Bankiewicz:2021:TML,% Brzeski:2022:ITB,% Chen:2023:DSC,% Choudhary:2022:DFT,% Cocic:2022:IWS,% Devi:2022:ENA,% Dutta:2021:RDP,% Fernandez:2022:BSI,% Gorantla:2023:SBC,% Gresh:2021:MCP,% Jablonski:2022:EEC,% Kido:2023:CHL,% Kohn:2023:CSG,% Kotaru:2023:MEI,% Kumar:2022:PML,% Langstieh:2023:LTD,% Levina:2021:ERE,% Li:2023:FIS,% Lo:2023:USH,% Ma:2021:IES,% Malcek:2020:CBD,% Marcisz:2022:ESR,% Munoz-Castro:2022:BCN,% Neugebauer:2023:HTS,% Parambath:2023:DQB,% Petrus:2020:PGA,% Pooja:2023:OSS,% Rasspe-Lange:2023:GBA,% Scoditti:2021:IEL,% Siebenmorgen:2020:PPP,% Sulka:2021:FNO,% Thomas-Hargreaves:2023:BST,% Xiong:2022:CBP,% Yang:2020:PCA,% deBeer:2020:CBM% }. \NAMECITE{component}{% Kanemaru:2023:SEF,% Kasper:2020:NTO% }. \NAMECITE{components}{% Afonin:2020:QDR,% Nanayakkara:2021:CEN% }. \NAMECITE{composite}{% Chan:2022:ADC,% Patel:2020:DBL% }. \NAMECITE{composites}{% Ma:2023:RSC% }. \NAMECITE{Composition}{% Yuan:2022:CSF,% Jager:2021:VOP% }. \NAMECITE{Composition-selective}{% Yuan:2022:CSF% }. \NAMECITE{compound}{% Evarestov:2020:OPI,% Higo:2021:GEM,% Qian:2022:PWO,% Saito:2020:SIMb% }. \NAMECITE{compound-protein}{% Qian:2022:PWO% }. \NAMECITE{Compounds}{% Patel:2020:DCI,% Sousa:2020:ASS,% Badorrek:2022:CSN,% Martinez-Araya:2022:ASC,% Minenkov:2023:ICB,% Muhasina:2023:VRT,% Nguyen:2022:BCC,% Novak:2023:DCD,% Pascale:2022:SOS,% Pascale:2023:HDC,% Pech:2020:QCT,% Qian:2022:PWO,% Safi:2021:BCP% }. \NAMECITE{Comprehensive}{% Yoshidome:2020:CRA,% Pakdel:2020:ESA,% Zarnecka:2023:FUF% }. \NAMECITE{compressed}{% Xu:2020:APN% }. \NAMECITE{compression}{% Cammi:2022:SDE% }. \NAMECITE{Comput}{% Mahajan:2020:EMC,% Weinhold:2021:CSW% }. \NAMECITE{Computation}{% Ammar:2020:FCW,% Chaparro:2020:PPB,% Garcia:2021:POB,% Mandal:2020:ECF,% Summa:2023:CFD% }. \NAMECITE{Computational}{% 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Garcia-Jacas:2020:DMQ,% Izsak:2023:QCP,% Jung:2021:NPC,% Macchiagodena:2023:RPT,% Pechlaner:2021:UMT% }. \NAMECITE{concentrations}{% Chao:2021:IPN% }. \NAMECITE{conceptual}{% Cocic:2022:IWS,% Geerlings:2023:EFC,% Merzoud:2021:UID% }. \NAMECITE{concern}{% Kim:2023:BHA,% Wassenaar:2022:ZST% }. \NAMECITE{concerning}{% Valdes:2020:TSA% }. \NAMECITE{concerted}{% Sorbelli:2022:ENB% }. \NAMECITE{condensation}{% Dubey:2023:IFM% }. \NAMECITE{condensed}{% Li:2022:SPI% }. \NAMECITE{condition}{% Gorantla:2022:UHR,% Mukhopadhyay:2020:ENR,% Yoshii:2020:FMM% }. \NAMECITE{conditions}{% Chao:2021:IPN,% Frazee:2021:IIP,% Lamine:2022:TER,% Prasad:2021:EES% }. \NAMECITE{conditions-mechanistic}{% Lamine:2022:TER% }. \NAMECITE{conductance}{% Kurisaki:2023:TCC% }. \NAMECITE{conducting}{% Luise:2022:MSP% }. \NAMECITE{conductivity}{% Kurisaki:2023:TCC,% Rublev:2023:OED% }. \NAMECITE{configuration}{% Carvalho:2022:CAR,% Mathea:2021:AVC,% Mathea:2022:AVC,% Pech:2020:QCT,% Schieschke:2021:GDE,% Wang:2020:PPC% }. 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Shao:2021:LCA,% Summa:2023:CFD% }. \NAMECITE{Current-Flow}{% Botello-Smith:2020:IPP% }. \NAMECITE{Curvature}{% Mitsuta:2023:CWN% }. \NAMECITE{Curvature-weighted}{% Mitsuta:2023:CWN% }. \NAMECITE{cut}{% Wilson:2022:ARI% }. \NAMECITE{cut-offs}{% Wilson:2022:ARI% }. \NAMECITE{cutoff}{% Diem:2020:EDC% }. \NAMECITE{cyanomethylation}{% Dutta:2021:RDP% }. \NAMECITE{cycle}{% Dorofeeva:2020:APN,% Menzel:2021:EWI% }. \NAMECITE{cyclin}{% Takaba:2022:PLB% }. \NAMECITE{cyclin-dependent}{% Takaba:2022:PLB% }. \NAMECITE{cyclization}{% Tian:2020:MDM% }. \NAMECITE{cycloaddition}{% Kacka-Zych:2022:MAS,% Merzoud:2021:UID,% Nacereddine:2021:CIS,% Salta:2022:DCT,% Sobhi:2023:UMR% }. \NAMECITE{cyclobutanes}{% Huang:2022:MSC% }. \NAMECITE{cyclocondensation}{% Maraf:2022:DRM% }. \NAMECITE{cyclooctatetraene}{% Kroeger:2022:GIP% }. \NAMECITE{cyclopenta}{% Mkadmh:2021:SID% }. \NAMECITE{cyclopropane}{% Wakchaure:2020:PBB% }. \NAMECITE{cyclotrimerization}{% Zhang:2021:CPC% }. \NAMECITE{cysteine}{% Dias-da-Silva:2021:EBT% }. \NAMECITE{cytosine}{% Liu:2022:DQM% }. \NAMECITE{{D}}{% Bai:2021:FRD,% Dare:2022:CRQ,% Freites:2023:ISD,% Guan:2023:DMS,% Pan:2023:FNS,% Pecoraro:2020:SEP,% Sahin:2020:NHM,% Tosso:2020:CES,% Tosso:2022:ECS,% Wilson:2022:ARI,% deCarvalho:2020:VTS% }. \NAMECITE{{D}-crystallin}{% Freites:2023:ISD% }. \NAMECITE{{D3}}{% Felix:2023:MAC,% Ramos:2021:DFF% }. \NAMECITE{{D4}}{% Najibi:2020:DDC% }. \NAMECITE{{D614G}}{% Omotuyi:2020:ASR% }. \NAMECITE{damaged}{% Carreon-Gonzalez:2022:CRD,% Liu:2022:DQM% }. \NAMECITE{Data}{% Baek:2022:DSF,% Smith:2020:KTR,% Trepte:2022:DDC,% Xu:2020:PNS,% Brown:2021:MCP,% Gkogka:2022:FMD,% Ishioka:2021:UGP,% Lubecka:2022:CGA,% Shu:2022:PFI% }. \NAMECITE{Data-driven}{% Trepte:2022:DDC% }. \NAMECITE{database}{% Andreadi:2022:TPE,% Crowet:2021:LDD,% Ligorio:2023:BBD,% Gehlhaar:2022:PCS% }. \NAMECITE{databases}{% Lian:2020:AMD,% Zarnecka:2023:FUF% }. \NAMECITE{datasets}{% Kelich:2023:BPS% }. \NAMECITE{Dative}{% Parambath:2023:DQB% }. \NAMECITE{{DD}}{% Cheng:2020:ADM% }. \NAMECITE{{DD}-peptidase}{% Cheng:2020:ADM% }. \NAMECITE{deacylation}{% Cheng:2020:ADM% }. \NAMECITE{deal}{% Ding:2020:EEP% }. \NAMECITE{Deciphering}{% Hoffmann:2021:DES% }. \NAMECITE{decker}{% Anila:2023:FMS% }. \NAMECITE{Decoding}{% Maraf:2022:DRM% }. \NAMECITE{decomposed}{% Nieuwland:2023:UCS% }. \NAMECITE{decomposition}{% Afonin:2020:QDR,% Alipour:2020:ABS,% Chen:2023:DSC,% Hayashi:2023:PAD,% Jara-Cortes:2022:FAE,% Luy:2023:BCI,% Merzoud:2021:UID,% Mukhopadhyay:2020:ENR,% Sugiyama:2021:RRN,% Tang:2021:XFM,% Zhang:2021:REF% }. \NAMECITE{decomposition-based}{% Mukhopadhyay:2020:ENR% }. \NAMECITE{decorporation}{% Sadhu:2020:PTC% }. \NAMECITE{decreasing}{% Hoffmann:2021:DES% }. \NAMECITE{dedicated}{% Crowet:2021:LDD% }. \NAMECITE{Deep}{% Laghuvarapu:2020:BND,% Perron:2022:DGM,% Jiang:2022:CRD,% Modee:2022:BSD,% Wu:2023:ESE% }. \NAMECITE{deeper}{% Devi:2022:ENA% }. \NAMECITE{deeply}{% Pascale:2023:HDC% }. \NAMECITE{{DEER}}{% Qi:2020:CGD% }. \NAMECITE{defective}{% Pecoraro:2020:SEP,% Shao:2021:LCA% }. \NAMECITE{defects}{% Contreras-Torres:2020:DCD,% Gentile:2020:SCD,% Platonenko:2021:ICD,% Popov:2021:LPP% }. \NAMECITE{Deformation}{% Fiorin:2020:DDF,% Nieuwland:2023:UCS,% Ravaei:2020:BDA% }. \NAMECITE{degenerate}{% Nhat:2021:ALE% }. \NAMECITE{degrees}{% Dey:2023:APP% }. \NAMECITE{dehydration}{% Kondo:2021:MSD,% Kondo:2021:RMT% }. \NAMECITE{dehydrogenated}{% Orjan:2020:CDG% }. \NAMECITE{delayed}{% Li:2022:NGQ% }. \NAMECITE{delivers}{% Zhang:2022:TCS% }. \NAMECITE{delivery}{% Abbasi:2022:COS% }. \NAMECITE{delocalization}{% Levina:2022:KET,% Rublev:2023:OED% }. \NAMECITE{delocalized}{% Bates:2021:CIB% }. \NAMECITE{Densities}{% Weinhold:2021:CSW,% Pilme:2020:QCT,% Summa:2023:CFD,% Tehrani:2023:ITA,% Wang:2021:RCS,% Wang:2021:SWD% }. \NAMECITE{Density}{% Boruah:2020:PRS,% Campos-Fernandez:2022:IND,% Cao:2020:DFS,% Choudhary:2022:DFT,% Fiorin:2020:DDF,% Kacka-Zych:2022:MAS,% Maley:2023:DFT,% Ramos:2021:DFF,% Ravaei:2020:BDA,% Smith:2020:KTR,% Taouali:2023:DFT,% Ye:2020:FBS,% Ahn:2020:PWA,% Ahn:2021:ALR,% Ali:2023:SEM,% Badalov:2020:PPG,% Bae:2022:TDD,% Benassi:2022:IDF,% Bozkaya:2020:SAC,% Brabec:2021:MPQ,% Bremond:2021:ACI,% Cao:2021:PIL,% Casanova-Paez:2021:GDH,% Cervinka:2022:TQH,% Chen:2020:SCC,% Cocic:2022:IWS,% Contreras-Torres:2020:DCD,% Damte:2020:BCD,% Duzenli:2022:IGE,% Evarestov:2021:AIA,% Fouda:2020:IPQ,% Gallmetzer:2022:PRA,% Geerlings:2023:EFC,% Geindre:2021:NLR,% Henkel:2021:UEC,% Hirao:2020:EEE,% Inamori:2020:SFA,% Kacka-Zych:2021:UMM,% Karton:2021:EDF,% Korsaye:2022:FDE,% Li:2021:APP,% Ma:2020:PPP,% Ma:2021:IES,% Macedo:2022:PEC,% Mandal:2022:ISP,% Martinez-Araya:2021:DPR,% Medves:2022:ODF,% Menzel:2021:EWI,% Merzoud:2021:UID,% Miyamoto:2020:SER,% Mkadmh:2021:SID,% Morera-Boado:2023:IEC,% Muller:2020:RTT,% Najibi:2020:DDC,% Nash:2023:CCA,% Nelson:2020:LLO,% Nieuwland:2023:UCS,% Nishimura:2020:HPD,% Orangi:2020:FLA,% Ottochian:2020:DHT,% Raucci:2020:EDB,% Rayon:2022:ADF,% Rublev:2023:OED,% Sadhu:2020:PTC,% Saito:2020:SIMa,% Santos:2021:CBH,% Sharma:2022:BDF,% Sobhi:2023:UMR,% Spotte-Smith:2020:ADA,% Su:2020:IHH,% Tomecek:2023:ACC,% Tran:2020:ESN,% Vega:2020:GGA,% Waite:2021:TSG,% Xie:2023:KID,% Zahn:2021:BDF,% Zhang:2023:DFS,% deBeer:2020:CBM% }. \NAMECITE{density-fitted}{% Bozkaya:2020:SAC% }. \NAMECITE{Density-functional}{% Taouali:2023:DFT,% Badalov:2020:PPG,% Nelson:2020:LLO% }. \NAMECITE{Depend}{% Bhattarai:2020:GPC% }. \NAMECITE{Dependence}{% Jablonski:2021:DSE,% Ye:2020:FBS,% Miyamoto:2020:SER,% Schieschke:2021:GDE% }. \NAMECITE{dependencies}{% Baek:2022:DSF% }. \NAMECITE{Dependent}{% Ye:2020:FBS,% Bae:2022:TDD,% Casanova-Paez:2021:GDH,% Fouda:2020:IPQ,% Fujimoto:2021:MRO,% Inamori:2020:SFA,% Inoue:2023:AQM,% Joseph:2020:MDA,% Medves:2022:ODF,% Muller:2020:RTT,% Ngo:2021:ELB,% Ottochian:2020:DHT,% Summa:2023:CFD,% Takaba:2022:PLB,% Taouali:2023:DFT,% Xi:2021:TDS,% Xie:2020:SMP% }. \NAMECITE{deposited}{% Valdes:2020:TSA% }. \NAMECITE{deposition}{% Mollahosseini:2022:EMI% }. \NAMECITE{Derivation}{% Fiorin:2020:DDF% }. \NAMECITE{derivative}{% Cammi:2022:SDE% }. \NAMECITE{Derivatives}{% Garcia-Rates:2020:ESC,% BenSaid:2021:ENS,% Campos-Fernandez:2022:IND,% Kroeger:2022:GIP,% Saleh:2021:NHD,% Sanchez-Gonzalez:2022:ICH,% Simone:2022:OPA,% Taouali:2023:DFT% }. \NAMECITE{describe}{% Geindre:2021:NLR,% Iuchi:2021:MEH% }. \NAMECITE{described}{% Kotaru:2023:MEI% }. \NAMECITE{Describing}{% Hutcheson:2021:DGE,% Macedo:2022:PEC,% Rasspe-Lange:2023:GBA% }. \NAMECITE{Description}{% Bader:2020:VCM,% Hughes:2020:FWM,% Xu:2020:RPA,% Zhang:2022:ARM% }. \NAMECITE{descriptors}{% BenSaid:2021:ENS,% Choudhary:2022:DFT,% Conti:2022:PAM,% Garcia-Jacas:2020:DMQ,% Hoffmann:2020:PEE,% Lefrancois-Gagnon:2020:TUS,% Lefrancois-Gagnon:2022:TUS,% Nanayakkara:2021:CEN,% Tortorella:2021:CML,% Yarish:2023:AMG% }. \NAMECITE{Design}{% Ignatchenko:2023:SPS,% Patel:2020:DCI,% Saleh:2021:NHD,% Brodney:2023:IDE,% Dutta:2021:RDP,% Gehlhaar:2022:PCS,% Haghshenas:2021:DVQ,% Lee:2023:BAM,% Li:2022:NGQ,% Lourenco:2023:GGA,% Novak:2023:DCD,% Perron:2022:DGM,% Prentis:2022:MEA,% Rajasekhar:2021:EPI,% Rajasekhar:2022:INI,% Sun:2023:RDI,% Yuan:2021:JDF,% Zhang:2021:RDN,% Zhang:2023:CRD% }. \NAMECITE{designs}{% Yang:2020:ODP% }. \NAMECITE{desirable}{% Novak:2023:DCD% }. \NAMECITE{detailed}{% Nourian:2023:IPR,% Shimoyama:2021:ADF% }. \NAMECITE{details}{% Tian:2020:MDM% }. \NAMECITE{determinant}{% Benedek:2022:SCC% }. \NAMECITE{Determination}{% Ngo:2020:OFE,% Cordina:2023:TMP,% Fujimori:2021:EBA% }. \NAMECITE{determines}{% Hussain:2020:IBT% }. \NAMECITE{Determining}{% Wu:2020:DOC,% Kramer:2023:ESD% }. \NAMECITE{deterministic}{% Trepte:2021:PCD% }. \NAMECITE{Developing}{% Haghshenas:2021:DVQ% }. \NAMECITE{Development}{% Khire:2023:DTA,% Liu:2022:DQM,% Shekarappa:2023:DML,% Sun:2023:DTHa,% Sun:2023:DTHb,% Wan:2020:DCG,% Goncalves:2022:SPT% }. \NAMECITE{developments}{% Valencia:2021:NDG% }. \NAMECITE{devices}{% Azizi:2020:NGQ,% Lu:2023:SMW,% Shao:2021:LCA% }. \NAMECITE{DFT}{% Taouali:2023:DFT,% Alipour:2020:ABS,% Anila:2023:FMS,% Avagliano:2022:API,% Benchehaima:2022:NOP,% Chamkin:2020:DDC,% Chen:2023:DSC,% Dobrovolskiy:2023:TDS,% Dutta:2021:RDP,% Fatkova:2023:VEE,% Felix:2023:MAC,% Forster:2020:DHD,% Haritha:2022:HPR,% Jharapla:2021:CDS,% Kotaru:2023:MEI,% Laplaza:2021:OEN,% Levina:2023:DPC,% Luise:2022:MSP,% Mendanha:2021:MDS,% Mondal:2023:SSS,% Munoz-Castro:2022:BCN,% Muz:2022:ZON,% Najibi:2020:DDC,% Rasspe-Lange:2023:GBA,% Scoditti:2021:IEL,% Stahl:2020:CAD,% Taouali:2023:DFT,% Tirri:2021:CMC,% Wang:2020:HAT,% Wei:2021:AES,% Wu:2023:DKS,% You:2023:EIM,% Zarate:2020:DMA,% Zeng:2020:SNS% }. \NAMECITE{{DFT-D4}}{% Najibi:2020:DDC% }. \NAMECITE{{DFT/MRCI}}{% Zarate:2020:DMA% }. \NAMECITE{Di-}{% Khakimov:2022:TTC% }. \NAMECITE{diagnostic}{% Sulka:2021:FNO% }. \NAMECITE{diagonalization}{% Blanc:2023:PLM,% Mrovec:2021:DFO,% Wang:2023:CPL% }. \NAMECITE{diagonalization-free}{% Mrovec:2021:DFO% }. \NAMECITE{diagrammatic}{% Hoffmann:2021:DES% }. \NAMECITE{diagrams}{% Panthi:2023:AAS,% Vilela:2020:PDZ% }. \NAMECITE{dianionic}{% Devillers:2020:CDP% }. \NAMECITE{diaqua}{% Malcek:2020:CBD% }. \NAMECITE{diatomic}{% Anisimov:2020:IEC,% Tzeli:2021:QCB% }. \NAMECITE{diatomics}{% Kaur:2022:LSH% }. \NAMECITE{diazadiboretidine}{% Nakatani:2021:AVE% }. \NAMECITE{dicarboranyl}{% Perumalla:2023:RDM% }. \NAMECITE{dications}{% Sadjadi:2021:BMG% }. \NAMECITE{dichalcogenide}{% Pecoraro:2020:SEP% }. \NAMECITE{dichroism}{% Monti:2022:CAM% }. \NAMECITE{dichromium}{% Malcek:2020:CBD% }. \NAMECITE{dicopper}{% Malcek:2020:CBD% }. \NAMECITE{dielectric}{% Reitz:2023:AOP% }. \NAMECITE{{Diels}}{% Mancera:2020:DAR,% Merzoud:2021:UID,% Nacereddine:2021:CIS,% Spotte-Smith:2020:ADA% }. \NAMECITE{diene}{% Nacereddine:2021:CIS% }. \NAMECITE{differences}{% Wieder:2022:AFE% }. \NAMECITE{different}{% Diem:2020:EDC,% Ding:2020:EEP,% Kido:2023:CHL,% Stsiapura:2020:SEE,% Wei:2021:AES% }. \NAMECITE{differential}{% Sulka:2021:FNO% }. \NAMECITE{diffuse}{% Minenkov:2023:ICB% }. \NAMECITE{diffusion}{% Baba:2022:PSD,% Carreon-Gonzalez:2022:CRD,% Fujimoto:2021:MRO,% Per:2020:RRS,% Rapallo:2021:EDT,% Serdtsev:2022:ESS,% Usler:2023:GES% }. \NAMECITE{diffusion-controlled}{% Carreon-Gonzalez:2022:CRD% }. \NAMECITE{diffusivity}{% Nag:2022:SHM% }. \NAMECITE{difluoro}{% Somnarin:2023:CIR% }. \NAMECITE{difluorocarbene}{% Zhang:2022:RTR% }. \NAMECITE{digestion}{% Neese:2023:SIG% }. \NAMECITE{dihalogens}{% Rahali:2023:HII% }. \NAMECITE{dihedral}{% Raubenolt:2022:SSP% }. \NAMECITE{Diimides}{% Narsaria:2020:PTV% }. \NAMECITE{diimine}{% Weiser:2023:SBP% }. \NAMECITE{diketones}{% Afonin:2020:QDR% }. \NAMECITE{dimensional}{% Gupta:2022:EHD,% Kar:2021:AFA,% Luise:2021:MUV,% Pal:2021:MFB,% Steglenko:2020:SEO,% Yoshii:2020:FMM% }. \NAMECITE{dimer}{% Bruce-Chwatt:2022:MMR,% Jana:2020:ESB,% Koput:2022:ICA,% Schwan:2023:IMC,% Yu:2023:TLM% }. \NAMECITE{Dimerization}{% Waschenbach:2020:DEG,% Byun:2023:CRK% }. \NAMECITE{dimers}{% Borah:2022:SZG,% McCutcheon:2023:AMC,% Weiser:2023:SBP% }. \NAMECITE{dinickel}{% Langstieh:2023:LTD% }. \NAMECITE{dinitrate}{% Gui:2021:ELM% }. \NAMECITE{dinitrogen}{% Devi:2022:ENA,% Kirkland:2023:CIF,% Schmitt:2023:TEC% }. \NAMECITE{dioxaphosphole}{% Mkadmh:2021:SID% }. \NAMECITE{dioxaphosphole-2-sulfide}{% Mkadmh:2021:SID% }. \NAMECITE{Dioxide}{% Stahl:2020:CAD,% Zhang:2020:MMP% }. \NAMECITE{Dipolar}{% Salta:2022:DCT% }. \NAMECITE{dipole}{% Bandyopadhyay:2023:MCG,% Bozkaya:2020:SAC,% Hernandez:2020:AIM,% Ligorio:2023:BBD% }. \NAMECITE{dipole-coupled}{% Bandyopadhyay:2023:MCG% }. \NAMECITE{Direct}{% Fiorin:2020:DDF,% Yu:2020:DHD% }. \NAMECITE{Directing}{% Alzahrani:2020:CAI% }. \NAMECITE{directions}{% Barletta:2022:ACC,% Martinez-Araya:2021:DPR,% Yoshii:2020:FMM% }. \NAMECITE{discovery}{% Chan:2021:MSM,% Lourenco:2023:GGA,% Martinez-Nunez:2021:AOS% }. \NAMECITE{Discriminating}{% Chen:2023:DUM% }. \NAMECITE{Disentanglement}{% Ciancaleoni:2020:DOH% }. \NAMECITE{Dismantlement}{% Yanez:2023:DAU% }. \NAMECITE{disorder}{% Dey:2023:APP% }. \NAMECITE{disordered}{% Shimoyama:2021:ADF% }. \NAMECITE{disparity}{% Ding:2020:EEP% }. \NAMECITE{dispersion}{% Contreras-Torres:2020:DCD,% Morera-Boado:2023:IEC,% Ramos:2021:DFF% }. \NAMECITE{dispersion-corrected}{% Contreras-Torres:2020:DCD% }. \NAMECITE{displacement}{% Ciancaleoni:2020:DOH,% Schmitt:2023:TEC% }. \NAMECITE{displacements}{% Martinez-Araya:2021:DPR% }. \NAMECITE{disruption}{% Madabeni:2020:CMB% }. \NAMECITE{dissimilar}{% Macchiagodena:2023:RPT% }. \NAMECITE{Dissociation}{% Dong:2021:DHP,% Dobrovolskiy:2023:TDS,% Macchiagodena:2023:RPT,% Spiriti:2022:SLD% }. \NAMECITE{Distance}{% Labiak:2022:DGP,% Koliogiorgos:2023:ETB,% Qi:2020:CGD,% Sarmah:2022:HSC% }. \NAMECITE{distinct}{% Nag:2022:SHM% }. \NAMECITE{distortion}{% Ebisawa:2021:GAA% }. \NAMECITE{Distributed}{% Garcia-Jacas:2020:DMQ,% Ligorio:2023:BBD% }. \NAMECITE{distribution}{% Inoue:2023:RNC,% Qi:2020:CGD,% Toutounji:2021:ESD% }. \NAMECITE{distributions}{% Long:2022:ERP,% Mifkovic:2022:CDH,% Stachowicz-Kusnierz:2020:CDM% }. \NAMECITE{disulfanediylbis}{% Mkadmh:2021:SID% }. \NAMECITE{Divalent}{% Patel:2020:DCI,% Arabzadeh:2022:HDL% }. \NAMECITE{diverse}{% Baba:2022:PSD,% Karton:2021:EDF% }. \NAMECITE{Divide}{% Jia:2021:FEC,% Fujimori:2021:EBA,% Nishimura:2020:HPD,% Shimoyama:2021:ADF% }. \NAMECITE{divide-and-conquer}{% Fujimori:2021:EBA,% Nishimura:2020:HPD,% Shimoyama:2021:ADF% }. \NAMECITE{{DJMol}}{% Prasanna:2021:DOS% }. \NAMECITE{{DLPNO}}{% Chamkin:2020:DDC,% Chan:2022:ADC,% Dorofeeva:2020:APN,% Garcia-Rates:2021:ISD,% Minenkov:2023:ICB,% Paiva:2020:AVD,% Sanchez:2020:CIS,% Seeger:2022:DCB% }. \NAMECITE{{DLPNO-CCSD}}{% Chamkin:2020:DDC,% Chan:2022:ADC,% Dorofeeva:2020:APN,% Minenkov:2023:ICB,% Paiva:2020:AVD,% Seeger:2022:DCB% }. \NAMECITE{{DLPNO-CEPA}}{% Sanchez:2020:CIS% }. \NAMECITE{{DLPNO-CEPA/1}}{% Sanchez:2020:CIS% }. \NAMECITE{{DMRG}}{% Lu:2023:HOS% }. \NAMECITE{{DMRG-CASSCF}}{% Lu:2023:HOS% }. \NAMECITE{{DNA}}{% Friis:2020:MEI,% Fukal:2022:AMM,% Harding:2020:IMS,% Salgado-Blanco:2023:EMP,% Sanchez-Gonzalez:2022:ICH% }. \NAMECITE{{DNN}}{% Xu:2022:EPH% }. \NAMECITE{do}{% Casanova-Paez:2021:GDH,% Grillo:2020:SMD,% Zhang:2020:FUT% }. \NAMECITE{Dock}{% Minh:2020:AGD,% Alonso-Gil:2021:PMS,% Prentis:2022:MEA% }. \NAMECITE{Docking}{% Xu:2020:PNS,% Bekker:2020:ESC,% Campos-Fernandez:2022:IND,% Lee:2023:GHP,% Maszota-Zieleniak:2021:ERE,% Mollahosseini:2022:EMI,% PhD:2021:INI,% Rajasekhar:2021:EPI,% Tosso:2022:ECS,% Vankayala:2022:PCN,% You:2023:EIM% }. \NAMECITE{dodecahedrane}{% Jana:2020:ESB% }. \NAMECITE{dodecyl}{% Zhang:2021:FEM% }. \NAMECITE{DOI}{% Mahajan:2020:EMC% }. \NAMECITE{Domain}{% Pant:2020:MCG,% Patel:2020:DBL,% Tolstykh:2022:UCA,% Byun:2023:CRK,% Garcia-Rates:2021:ISD,% Sanejouand:2021:NMD% }. \NAMECITE{Domain-based}{% Patel:2020:DBL% }. \NAMECITE{donation}{% Gutsev:2020:IBD% }. \NAMECITE{donor}{% Das:2023:BSE,% Parambath:2023:DQB% }. \NAMECITE{dopamine}{% Tosso:2020:CES,% Tosso:2022:ECS% }. \NAMECITE{doped}{% Damte:2020:BCD,% Duzenli:2022:IGE,% Wang:2022:SEE,% Zeng:2020:SNS% }. \NAMECITE{Double}{% Forster:2020:DHD,% Ottochian:2020:DHT,% Al-Qaisi:2023:TIL,% Bremond:2021:ACI,% Casanova-Paez:2021:GDH% }. \NAMECITE{double-hybrid}{% Bremond:2021:ACI% }. \NAMECITE{Doubles}{% Haase:2020:NDC% }. \NAMECITE{downregulation}{% Chinnasamy:2020:IBM% }. \NAMECITE{downward}{% Ebisawa:2021:GAA% }. \NAMECITE{DPC}{% Zhang:2021:FEM% }. \NAMECITE{drive}{% Riccardi:2020:PID% }. \NAMECITE{driven}{% Anand:2020:ESI,% Salgado-Blanco:2023:EMP,% Sanejouand:2021:NMD,% Stylianakis:2020:BBS,% Trepte:2022:DDC,% Yang:2022:PIE% }. \NAMECITE{{Drude}}{% Bandyopadhyay:2023:MCG,% Kognole:2022:PCG,% Kumar:2020:FSP,% Lin:2020:IMC,% Orabi:2020:DPF% }. \NAMECITE{Drug}{% Sixto-Lopez:2021:DRT,% Abbasi:2022:COS,% Druchok:2021:TEG,% Haghshenas:2021:DVQ,% Lee:2023:BAM,% Rajasekhar:2021:EPI,% Rajasekhar:2022:INI% }. \NAMECITE{drug-delivery}{% Abbasi:2022:COS% }. \NAMECITE{drug-like}{% Druchok:2021:TEG% }. \NAMECITE{druglike}{% Sun:2023:DTHa% }. \NAMECITE{drugs}{% Haritha:2022:HPR,% Haritha:2023:HBO,% Hirakawa:2020:BME,% Nhat:2020:EBM,% Pakdel:2020:ESA,% delCastillo:2021:IGA% }. \NAMECITE{Dual}{% Yu:2020:DHD,% Macchiagodena:2023:RPT% }. \NAMECITE{dual-atom}{% Dong:2023:EZL% }. \NAMECITE{Dual-hybrid}{% Yu:2020:DHD% }. \NAMECITE{due}{% Fukal:2022:AMM,% Martinez-Araya:2021:DPR,% Ohlknecht:2020:CEA% }. \NAMECITE{dyes}{% Tirri:2021:CMC% }. \NAMECITE{dynamic}{% Bekker:2020:ESC,% Mendanha:2021:MDS,% Monroe:2022:USM,% Schmitz:2021:AWM% }. \NAMECITE{dynamical}{% Raubenolt:2022:SSP,% Summa:2023:CFD% }. \NAMECITE{dynamically}{% Mukhopadhyay:2020:ENR,% Takaba:2022:PLB% }. \NAMECITE{Dynamics}{% Fiorin:2020:DDF,% Hwang:2020:MMM,% Kusumoto:2020:SIA,% Ye:2020:FBS,% Zaczek:2020:MSF,% Andoh:2021:AMM,% Arabzadeh:2022:HDL,% Baba:2022:PSD,% Bekker:2020:ESC,% Boziki:2022:TPU,% Chan:2021:MSM,% Chinnasamy:2020:IBM,% Cordina:2023:TMP,% Dong:2021:DHP,% Fujimoto:2021:MRO,% Fukal:2022:AMM,% Ghalami:2020:AST,% Gkogka:2022:FMD,% Joseph:2020:MDA,% Jung:2021:NPC,% Kalathingal:2023:MMB,% Koehl:2021:PEN,% Kognole:2022:PCG,% Lai:2021:NGC,% Larsson:2020:MTC,% Lee:2021:PPB,% Lourenco:2021:MDS,% Mandal:2020:ECF,% Mandal:2022:ISP,% Marcisz:2022:ESR,% Mollahosseini:2022:EMI,% Muthusivarajan:2020:RAR,% Nam:2023:SSP,% Nishimura:2020:HPD,% Nourian:2023:IPR,% Ootani:2020:TFM,% Parkman:2021:CNP,% Pechlaner:2021:MAB,% Pechlaner:2021:UMT,% Perumalla:2023:RDM,% PhD:2021:INI,% Priyadarsini:2021:CFP,% Qi:2020:CGD,% Rajasekhar:2021:EPI,% Rajasekhar:2022:INI,% Rapallo:2021:EDT,% Raucci:2020:IMD,% Saputri:2020:CLA,% Shiga:2022:PIB,% Shimoyama:2021:ADF,% Shu:2022:PFI,% Simko:2022:QCP,% Solovyov:2022:MMS,% Stachowicz-Kusnierz:2020:CDM,% Sun:2021:EMB,% Terteci-Popescu:2022:BPC,% Usler:2023:GES,% Valdes:2023:CCI,% Wang:2020:LCD,% Wang:2023:MBR,% Wieder:2022:AFE,% Wu:2021:AHP,% You:2023:EIM,% Zhang:2021:REF,% Zhang:2022:TCS,% Zhou:2020:RCI% }. \NAMECITE{{E}-fields}{% Azizi:2020:NGQ% }. \NAMECITE{{E4}}{% Wei:2021:AES% }. \NAMECITE{ebselen}{% You:2023:EIM% }. \NAMECITE{{EDA}}{% Devi:2022:ENA,% Gorantla:2022:UHR,% Gorantla:2023:SBC% }. \NAMECITE{{EDA-NOCV}}{% Devi:2022:ENA,% Gorantla:2022:UHR,% Gorantla:2023:SBC% }. \NAMECITE{edge}{% Cerezo:2023:FVR% }. \NAMECITE{Effect}{% Alzahrani:2020:CAI,% Dong:2023:EZL,% Garcia-Rates:2020:ESC,% Jana:2020:ESB,% Afonin:2022:GTC,% Chenouf:2020:EEC,% Diem:2020:EDC,% Friis:2020:MEI,% Jiang:2020:TAK,% Kramer:2023:ESD,% Krog:2023:MCA,% Leskourova:2022:ECH,% Li:2023:SRE,% Martinez-Araya:2021:DPR,% Matveeva:2022:EMF,% Pakdel:2020:ESA,% Stsiapura:2020:SEE,% Sun:2021:REF,% Xi:2021:TDS% }. \NAMECITE{effective}{% Blasiak:2021:IEO,% Kotaru:2023:MEI,% Unzueta:2020:PCM% }. \NAMECITE{Effects}{% Dobrovolskiy:2023:TDS,% Jiang:2020:MSU,% Kirschbaum:2022:EOA,% Kurisaki:2023:TCC,% Mollahosseini:2022:EMI,% Savoo:2020:ASA,% Sosa:2020:ELE,% Chao:2021:IPN,% Fukal:2022:AMM,% Gallegos:2022:RSP,% Gutsev:2020:IBD,% Kanemaru:2023:SEF,% Munoz-Castro:2022:BCN,% Porwal:2023:HEV,% Sabater:2023:CSE,% deCarvalho:2020:VTS% }. \NAMECITE{efficiency}{% Fukuhara:2023:IPR% }. \NAMECITE{Efficient}{% Casals-Sainz:2020:EII,% Luy:2021:EHM,% Mandal:2020:ECF,% Mathea:2021:AVC,% Menzel:2021:EWI,% Mukhopadhyay:2020:ENR,% Pal:2021:MFB,% Ramm:2021:EMR,% Xu:2022:EPH,% Ahirwar:2023:FFM,% Druchok:2021:TEG,% Ehlert:2020:PPP,% Khire:2023:DTA,% Kotowski:2021:PEA,% Zhang:2021:RDN% }. \NAMECITE{effort}{% Pechlaner:2021:UMT% }. \NAMECITE{eigenvalues}{% Kiani:2021:MLE% }. \NAMECITE{{Eighth}}{% Prasad:2021:EES% }. \NAMECITE{{Eighth-Shell}}{% Prasad:2021:EES% }. \NAMECITE{elacestrant}{% Chinnasamy:2020:IBM% }. \NAMECITE{elastic}{% Koehl:2021:PEN,% Mitsuta:2023:CWN,% Mitsuta:2023:NES,% Morin-Martinez:2023:QBA,% Zhang:2022:ARM% }. \NAMECITE{Electric}{% Poleto:2022:TEF,% Stuyver:2020:TCM,% Zhang:2021:REF% }. \NAMECITE{electride}{% Das:2020:EMI% }. \NAMECITE{electrocatalysts}{% Ananthaneni:2020:CST% }. \NAMECITE{electrochemical}{% Kiani:2021:MLE% }. \NAMECITE{Electrocyclization}{% Palmeiro:2021:EM% }. \NAMECITE{electrode}{% Duzenli:2022:IGE% }. \NAMECITE{electrolyte}{% Lourenco:2021:MDS% }. \NAMECITE{electrolytes}{% Eisele:2020:MMK,% Henkel:2021:UEC% }. \NAMECITE{Electron}{% Kacka-Zych:2022:MAS,% Bertolini:2022:VEC,% Blasiak:2021:IEO,% Eidi:2021:HOH,% Evarestov:2021:AIA,% Inoue:2023:AQM,% Kacka-Zych:2021:UMM,% Levina:2021:ERE,% Levina:2022:KET,% Levina:2023:DPC,% Macedo:2022:PEC,% Martinez-Araya:2021:DPR,% Parambath:2023:DQB,% Raucci:2020:EDB,% Rolfes:2020:AES,% Rublev:2023:OED,% Sahin:2020:NHM,% Saputri:2020:CLA,% Sobhi:2023:UMR,% Sugiura:2020:PEC,% Summa:2023:CFD,% Tehrani:2023:ITA,% deBeer:2020:CBM% }. \NAMECITE{electronegativity}{% Vyboishchikov:2023:QSE% }. \NAMECITE{Electronic}{% Douglas-Gallardo:2020:ESB,% Salgado-Blanco:2023:EMP,% Serdtsev:2022:ESS,% Speelman:2021:ECS,% Tran:2020:ESN,% Ali:2023:SEM,% Azizi:2020:NGQ,% Benedek:2022:SCC,% Cammi:2022:SDE,% Hokmi:2021:CSN,% Iuchi:2021:MEH,% Jharapla:2021:CDS,% Kanemaru:2023:SEF,% Kirschbaum:2022:EOA,% Koput:2022:ICA,% 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\NAMECITE{{IR}}{% Tupikina:2021:EFH,% Damte:2020:BCD% }. \NAMECITE{iron}{% Chen:2023:DSC,% Gorantla:2023:SBC,% Jablonski:2022:PNU,% Kotaru:2023:MEI,% Sun:2023:RDI% }. \NAMECITE{irradiation}{% Li:2022:NGQ% }. \NAMECITE{Irreducible}{% Balasubramanian:2020:CCH% }. \NAMECITE{isodesmic}{% Waite:2021:TSG% }. \NAMECITE{isodesmic-type}{% Waite:2021:TSG% }. \NAMECITE{Isoelectronic}{% Zheng:2020:MSIb,% Salta:2022:DCT,% Schmitt:2023:TEC,% Zheng:2020:MSIa% }. \NAMECITE{isolable}{% Fernandez:2022:BSI% }. \NAMECITE{isolated}{% Curtolo:2022:MPT,% Ignatchenko:2023:SPS,% Jager:2021:VOP,% Lo:2023:USH% }. \NAMECITE{Isolation}{% Bader:2020:VCM,% Ligorio:2023:BBD% }. \NAMECITE{isoleucine}{% Mendanha:2021:MDS% }. \NAMECITE{isomerase}{% Devillers:2020:CDP% }. \NAMECITE{isomerization}{% Ohno:2021:HPG% }. \NAMECITE{isomers}{% Ohno:2021:HPG,% Orjan:2020:CDG% }. \NAMECITE{isothermal}{% Lai:2021:NGC% }. \NAMECITE{isotope}{% Jiang:2020:TAK,% deCarvalho:2020:VTS% }. \NAMECITE{isotopologues}{% Schneider:2023:QCR% }. \NAMECITE{{iSPECTRON}}{% Segatta:2021:ISI% }. \NAMECITE{Issue}{% Anonymous:2020:CIVa,% Anonymous:2020:CIVb,% Anonymous:2020:CIVba,% Anonymous:2020:CIVbb,% Anonymous:2020:CIVc,% Anonymous:2020:CIVd,% Anonymous:2020:CIVe,% Anonymous:2020:CIVf,% Anonymous:2020:CIVg,% Anonymous:2020:CIVh,% Anonymous:2020:CIVi,% Anonymous:2020:CIVj,% Anonymous:2020:CIVk,% Anonymous:2020:CIVl,% Anonymous:2020:CIVm,% Anonymous:2020:CIVo,% Anonymous:2020:CIVp,% Anonymous:2020:CIVq,% Anonymous:2020:CIVr,% Anonymous:2020:CIVs,% Anonymous:2020:CIVt,% Anonymous:2020:CIVu,% Anonymous:2020:CIVv,% Anonymous:2020:CIVw,% Anonymous:2020:CIVx,% Anonymous:2020:CIVy,% Anonymous:2020:CIVz,% Anonymous:2020:IIa,% Anonymous:2020:IIb,% Anonymous:2020:IIba,% Anonymous:2020:IIbb,% Anonymous:2020:IIbc,% Anonymous:2020:IIbd,% Anonymous:2020:IIbe,% Anonymous:2020:IIbf,% Anonymous:2020:IIc,% Anonymous:2020:IId,% Anonymous:2020:IIe,% Anonymous:2020:IIf,% Anonymous:2020:IIg,% Anonymous:2020:IIh,% Anonymous:2020:IIi,% Anonymous:2020:IIj,% Anonymous:2020:IIk,% Anonymous:2020:IIl,% Anonymous:2020:IIm,% Anonymous:2020:IIn,% Anonymous:2020:IIo,% Anonymous:2020:IIp,% Anonymous:2020:IIq,% Anonymous:2020:IIr,% Anonymous:2020:IIs,% Anonymous:2020:IIt,% Anonymous:2020:IIu,% Anonymous:2020:IIv,% Anonymous:2020:IIw,% Anonymous:2020:IIx,% Anonymous:2020:IIy,% Anonymous:2020:IIz,% Anonymous:2021:IIa,% Anonymous:2021:IIb,% Anonymous:2021:IIba,% Anonymous:2021:IIbb,% Anonymous:2021:IIbc,% Anonymous:2021:IIbd,% Anonymous:2021:IIbe,% Anonymous:2021:IIbf,% Anonymous:2021:IIbg,% Anonymous:2021:IIc,% Anonymous:2021:IIe,% Anonymous:2021:IIf,% Anonymous:2021:IIg,% Anonymous:2021:IIh,% Anonymous:2021:IIi,% Anonymous:2021:IIj,% Anonymous:2021:IIk,% Anonymous:2021:IIl,% Anonymous:2021:IIm,% Anonymous:2021:IIn,% Anonymous:2021:IIo,% Anonymous:2021:IIp,% Anonymous:2021:IIq,% Anonymous:2021:IIr,% Anonymous:2021:IIs,% Anonymous:2021:IIt,% Anonymous:2021:IIu% }. \NAMECITE{Issue}{% Anonymous:2021:IIv,% Anonymous:2021:IIw,% 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\NAMECITE{laser-induced}{% Simko:2022:QCP% }. \NAMECITE{Late}{% Patel:2020:PPL% }. \NAMECITE{lattice}{% Nguyen:2021:PLE% }. \NAMECITE{layer}{% Yu:2023:TLM% }. \NAMECITE{layered}{% Evarestov:2020:TAC% }. \NAMECITE{layers}{% Luy:2021:EHM% }. \NAMECITE{lead}{% Al-Qaisi:2023:TIL% }. \NAMECITE{lead-free}{% Al-Qaisi:2023:TIL% }. \NAMECITE{Leading}{% Alzahrani:2020:CAI,% Najibi:2020:DDC% }. \NAMECITE{leapfrog}{% Muya:2021:SSB% }. \NAMECITE{Learning}{% Laghuvarapu:2020:BND,% Burn:2022:PCA,% Casier:2021:HLG,% Conti:2022:PAM,% Hoffmann:2020:PEE,% Jiang:2022:CRD,% Kanamaru:2022:FAE,% Kong:2022:MPR,% Kumar:2022:PML,% Ma:2023:MLA,% Nikolaienko:2022:CML,% Rezende:2023:ABG,% Shekarappa:2023:DML,% Tortorella:2021:CML,% Walter:2021:MML,% Wu:2023:ESE,% Yang:2020:PCA% }. \NAMECITE{learning-assisted}{% Walter:2021:MML% }. \NAMECITE{length}{% Flachsenberg:2021:LOS,% Malcek:2020:CBD% }. \NAMECITE{{Lennard}}{% Sikorska:2020:MLJ% }. \NAMECITE{{Lennard-Jones}}{% Sikorska:2020:MLJ% }. \NAMECITE{less}{% 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\NAMECITE{multideterminant}{% Kim:2023:FPL% }. \NAMECITE{multidimensional}{% Bruce-Chwatt:2022:MMR,% Gangopadhyay:2021:ANP% }. \NAMECITE{multifunctionalized}{% Alonso-Gil:2021:PMS% }. \NAMECITE{multilayer}{% Izsak:2023:QCP% }. \NAMECITE{multilevel}{% Safi:2021:BCP% }. \NAMECITE{Multilinear}{% Wan:2020:DCG% }. \NAMECITE{Multimolecular}{% Gresh:2021:MCP% }. \NAMECITE{Multiple}{% Sakae:2020:APB,% Mandal:2022:ISP,% Pechlaner:2021:UMT,% Wang:2023:MBR,% Xie:2020:SMP% }. \NAMECITE{multiple-time-step}{% Pechlaner:2021:UMT% }. \NAMECITE{Multipolar}{% Hughes:2020:FWM,% Yuan:2021:MEH% }. \NAMECITE{multipole}{% Andoh:2020:EFM,% Andoh:2021:AMM,% Muller:2020:RTT,% Yoshii:2020:FMM% }. \NAMECITE{multipurpose}{% Tang:2021:XFM% }. \NAMECITE{multireference}{% Sulka:2021:FNO% }. \NAMECITE{Multiscale}{% Solovyov:2022:MMS,% Freites:2023:ISD,% Lian:2020:AMD,% Liu:2021:AAS,% Marti:2021:QQA% }. \NAMECITE{mussel}{% Mollahosseini:2022:EMI% }. \NAMECITE{mussel-inspired}{% Mollahosseini:2022:EMI% }. \NAMECITE{mutant}{% Baek:2022:DSF,% Chinnasamy:2020:IBM% }. \NAMECITE{mutations}{% Hayes:2021:SPG% }. \NAMECITE{{Mycobacterium}}{% Rajasekhar:2022:INI% }. \NAMECITE{n}{% Zeng:2020:SNS,% Afonin:2022:MTA,% Barcza:2022:CAI,% Damte:2020:BCD,% Gorantla:2023:SBC,% Jain:2022:AMA,% Matsuoka:2020:RTT,% Patel:2020:DCI,% Rayon:2022:ADF,% Xu:2022:EPH,% Temel:2023:PAM% }. \NAMECITE{{N}-co-doped}{% Damte:2020:BCD% }. \NAMECITE{{N}-heterocycles}{% Barcza:2022:CAI% }. \NAMECITE{{N}-heterocyclic}{% Jain:2022:AMA% }. \NAMECITE{{N}-Terminal}{% Matsuoka:2020:RTT% }. \NAMECITE{{NADH}}{% Campos-Fernandez:2022:IND% }. \NAMECITE{{NADH-fumarate}}{% Campos-Fernandez:2022:IND% }. \NAMECITE{{NADP}}{% Cao:2020:DFS% }. \NAMECITE{{NADPH}}{% Cao:2020:DFS% }. \NAMECITE{named}{% Sahin:2020:NHM% }. \NAMECITE{nano}{% Fan:2023:SSP% }. \NAMECITE{nano-hoops}{% Fan:2023:SSP% }. \NAMECITE{nanobelts}{% Ahn:2021:ALR% }. \NAMECITE{nanoclusters}{% Gutsev:2020:IBD,% Muz:2022:ZON% }. \NAMECITE{nanocrystals}{% Koliogiorgos:2023:ETB,% Milovanovic:2021:SLC% }. \NAMECITE{nanodiamonds}{% Kirschbaum:2022:EOA% }. \NAMECITE{nanometer}{% Nair:2021:RAO% }. \NAMECITE{nanoparticle}{% Long:2022:ERP% }. \NAMECITE{nanoparticles}{% Bae:2022:TDD% }. \NAMECITE{nanopores}{% Yadav:2020:THN% }. \NAMECITE{nanoreactor}{% Faizan:2023:ABA% }. \NAMECITE{nanoribbons}{% Shao:2021:LCA% }. \NAMECITE{nanoring}{% Yuan:2022:CSF% }. \NAMECITE{nanoscale}{% Sikorska:2020:MLJ% }. \NAMECITE{{NanoShaper}}{% Wilson:2021:CMN% }. \NAMECITE{nanotube}{% Ahn:2020:PWA,% Contreras-Torres:2020:DCD% }. \NAMECITE{Nanotubes}{% Domnin:2020:FPC,% Badorrek:2022:CSN,% Chenouf:2020:EEC,% Vassetti:2020:ACS% }. \NAMECITE{Naphthalene}{% Narsaria:2020:PTV% }. \NAMECITE{naphthyridine}{% Weiser:2023:SBP% }. \NAMECITE{Natural}{% Kasper:2020:NTO,% Ciancaleoni:2020:DOH,% Garcia-Rates:2021:ISD,% Miyamoto:2020:SER,% Patel:2020:DBL,% Scheiner:2022:RAM,% Sulka:2021:FNO% }. \NAMECITE{Nature}{% Malcek:2020:CBD,% Panthi:2023:AAS,% Weinhold:2021:CSW,% Beck:2021:UIH,% Bedford:2021:NPI,% Fan:2023:SSP,% Hokmi:2021:CSN,% Jablonski:2022:PNU,% Konovalov:2021:MBN,% McCutcheon:2023:AMC,% Muhasina:2023:VRT,% Nanayakkara:2021:CEN,% Wang:2021:RCS,% Wang:2021:SWD,% deAraujo:2023:HCN% }. \NAMECITE{{NaY}}{% Nag:2022:SHM% }. \NAMECITE{{NbGe}}{% Tran:2020:ESN% }. \NAMECITE{{NBO}}{% Lamine:2022:TER% }. \NAMECITE{NbX}{% Ali:2023:SEM% }. \NAMECITE{{NCF}}{% Orangi:2020:FLA% }. \NAMECITE{{NE-RDFE}}{% Macchiagodena:2023:RPT% }. \NAMECITE{near}{% Izsak:2023:QCP% }. \NAMECITE{needs}{% Nikolaienko:2022:CML% }. \NAMECITE{negative}{% Tehrani:2023:ITA% }. \NAMECITE{neighbor}{% Goncalves:2022:SPT% }. \NAMECITE{neon}{% Li:2023:FIS% }. \NAMECITE{neopentane}{% Nag:2022:SHM% }. \NAMECITE{{NeRF}}{% Alcaide:2022:MNM% }. \NAMECITE{Nernst}{% Chao:2021:IPN% }. \NAMECITE{net}{% Ohlknecht:2020:CEA% }. \NAMECITE{net-charge}{% Ohlknecht:2020:CEA% }. \NAMECITE{Network}{% Botello-Smith:2020:IPP,% Koehl:2021:PEN,% Matyszczak:2021:AAN,% Modee:2022:BSD,% Nikolaienko:2022:CML,% Rublev:2023:OED,% Sugiyama:2021:RRN,% Tashiro:2021:NGO% }. \NAMECITE{networks}{% Vilela:2020:PDZ% }. \NAMECITE{neural}{% Matyszczak:2021:AAN,% Modee:2022:BSD,% Nikolaienko:2022:CML,% Tashiro:2021:NGO% }. \NAMECITE{neuroglobin}{% Freindorf:2022:CBH% }. \NAMECITE{Neutral}{% Lai:2021:NGC,% Borocci:2020:CHN,% Kumar:2023:BPS,% Minenkov:2023:ICB,% Muhasina:2023:VRT% }. \NAMECITE{Neutralizing}{% Kusumoto:2020:SIA% }. \NAMECITE{{NEVPT2}}{% Chamkin:2020:DDC% }. \NAMECITE{{Newton}}{% Mukhopadhyay:2020:ENR% }. \NAMECITE{Next}{% Azizi:2020:NGQ,% Li:2022:NGQ% }. \NAMECITE{Next-generation}{% Azizi:2020:NGQ% }. \NAMECITE{Ng}{% Arrue:2021:SCB% }. \NAMECITE{{NgX}}{% Arrue:2021:SCB% }. \NAMECITE{NH}{% Orangi:2020:FLA,% Xi:2021:TDS,% Haritha:2023:HBO,% Savoo:2020:ASA% }. \NAMECITE{{NHCs}}{% Dubey:2023:IFM% }. \NAMECITE{Ni}{% Liu:2022:GES,% Serdtsev:2022:ESS,% Parambath:2023:DQB% }. \NAMECITE{{{NIAS}}}{% Feltes:2023:NSV% }. \NAMECITE{{{NIAS}-Server}}{% Feltes:2023:NSV% }. \NAMECITE{nickel}{% Dutta:2021:RDP,% Langstieh:2023:LTD,% Zhang:2021:RDN% }. \NAMECITE{nickel-nickel}{% Langstieh:2023:LTD% }. \NAMECITE{nicotinic}{% Beck:2021:UIH% }. \NAMECITE{nitrate}{% Yadav:2020:THN% }. \NAMECITE{Nitreones}{% Patel:2020:DCI% }. \NAMECITE{nitrilotriacetate}{% Chen:2023:DSC% }. \NAMECITE{nitrite}{% Yadav:2020:THN% }. \NAMECITE{nitroalkenes}{% Kacka-Zych:2022:MAS% }. \NAMECITE{nitrobenzaldehyde}{% Voros:2023:ESO% }. \NAMECITE{nitrocellulose}{% Zhang:2022:ARM% }. \NAMECITE{nitrogen}{% Jharapla:2021:CDS,% Xu:2020:APN% }. \NAMECITE{nitrogen-rich}{% Jharapla:2021:CDS% }. \NAMECITE{nitrogenase}{% Gorantla:2023:SBC,% Wei:2021:AES% }. \NAMECITE{nitroimidazole}{% Campos-Fernandez:2022:IND% }. \NAMECITE{nitronates}{% Kacka-Zych:2022:MAS% }. \NAMECITE{nitroprop}{% Sobhi:2023:UMR% }. \NAMECITE{nitrosyl}{% Kido:2023:CHL% }. \NAMECITE{nitrous}{% Kacka-Zych:2021:UMM% }. \NAMECITE{nitroxide}{% McCutcheon:2023:AMC% }. \NAMECITE{NLi}{% Sarmah:2022:HSC% }. \NAMECITE{{NMR}}{% Benassi:2022:IDF,% Fukal:2022:AMM,% Lubecka:2022:CGA,% Mendanha:2021:MDS,% Mifkovic:2022:CPP,% Munoz-Castro:2022:BCN,% Saielli:2023:CNS,% Tupikina:2020:LPM% }. \NAMECITE{{NMR}-data-assisted}{% Lubecka:2022:CGA% }. \NAMECITE{{NN}}{% Laghuvarapu:2020:BND% }. \NAMECITE{NO}{% Ohno:2021:HPG% }. \NAMECITE{noble}{% Arrue:2021:SCB,% Mazumder:2023:BBN,% Yashmin:2023:CNG% }. \NAMECITE{{NOCV}}{% Devi:2022:ENA,% Gorantla:2022:UHR,% Gorantla:2023:SBC,% Sorbelli:2022:ENB% }. \NAMECITE{{Noggin}}{% Choudhuri:2020:SBB% }. \NAMECITE{Non}{% Geindre:2021:NLR,% Karachi:2023:BHS,% Bates:2021:CIB,% Lamine:2022:TER,% Muhasina:2023:VRT,% Tehrani:2023:ITA,% Vyboishchikov:2021:FNI% }. \NAMECITE{non-aqueous}{% Vyboishchikov:2021:FNI% }. \NAMECITE{non-bonding}{% Muhasina:2023:VRT% }. \NAMECITE{non-classical}{% Bates:2021:CIB% }. \NAMECITE{non-iterative}{% Vyboishchikov:2021:FNI% }. \NAMECITE{non-negative}{% Tehrani:2023:ITA% }. \NAMECITE{Non-nuclear}{% Karachi:2023:BHS% }. \NAMECITE{non-thermal}{% Lamine:2022:TER% }. \NAMECITE{nonadiabatic}{% Saito:2020:SIMb% }. \NAMECITE{nonaqueous}{% Raucci:2020:IMD% }. \NAMECITE{noncovalent}{% Badorrek:2022:CSN,% Chen:2020:TLC,% Contreras-Torres:2020:DCD,% Orangi:2020:FLA,% Otlyotov:2023:GPT,% Ramos:2021:DFF,% Scheiner:2022:RAM,% Yu:2020:DHD% }. \NAMECITE{nonelectrostatic}{% Vassetti:2022:TTN% }. \NAMECITE{nonequilibrium}{% Macchiagodena:2023:RPT% }. \NAMECITE{nonfullerene}{% Taouali:2023:DFT% }. \NAMECITE{Noniterative}{% Haase:2020:NDC% }. \NAMECITE{Nonlinear}{% Benchehaima:2022:NOP,% Segatta:2021:ISI% }. \NAMECITE{nonlocal}{% Ramos:2021:DFF,% Trepte:2022:DDC,% Yu:2020:DHD% }. \NAMECITE{Nonredundant}{% Xu:2020:PNS% }. \NAMECITE{Nonrigid}{% Balasubramanian:2020:NWO% }. \NAMECITE{nonuniform}{% Yang:2020:EME% }. \NAMECITE{norbornadiene}{% Dorofeeva:2020:APN% }. \NAMECITE{norbornene}{% Munoz-Castro:2022:BCN% }. \NAMECITE{norcarane}{% Ma:2021:IES% }. \NAMECITE{Normal}{% Sanejouand:2021:NMD% }. \NAMECITE{Normal-mode}{% Sanejouand:2021:NMD% }. \NAMECITE{norovirus}{% Lipska:2023:LTS% }. \NAMECITE{Novel}{% Saleh:2021:NHD,% Li:2021:TNS,% PhD:2021:INI,% Rajasekhar:2022:INI,% Sahin:2020:NHM,% Vankayala:2022:PCN% }. \NAMECITE{novo}{% Perron:2022:DGM,% Tashiro:2021:NGO% }. \NAMECITE{{NS5B}}{% Malik:2020:HWS% }. \NAMECITE{{NSP15}}{% Sixto-Lopez:2021:DRT% }. \NAMECITE{nuclear}{% Inoue:2023:RNC,% Karachi:2023:BHS,% Laplaza:2021:OEN,% Lubecka:2021:EAE,% Vassetti:2020:ACS% }. \NAMECITE{nuclear-magnetic-resonance-assisted}{% Lubecka:2021:EAE% }. \NAMECITE{nucleation}{% Krog:2023:MCA% }. \NAMECITE{nucleobases}{% Contreras-Torres:2020:DCD% }. \NAMECITE{nucleophilic}{% Cuesta:2021:CSR% }. \NAMECITE{nucleotide}{% Xiong:2022:CBP% }. \NAMECITE{Nudged}{% Mitsuta:2023:NES,% Mitsuta:2023:CWN,% Zhang:2022:ARM% }. \NAMECITE{number}{% Mukhopadhyay:2020:ENR% }. \NAMECITE{numbers}{% Aquino:2020:FON,% Sulka:2021:FNO% }. \NAMECITE{numbers-based}{% Sulka:2021:FNO% }. \NAMECITE{numerical}{% Chao:2021:IPN,% Dang:2022:NES,% Gangopadhyay:2021:ANP,% Pan:2023:FNS% }. \NAMECITE{O}{% Gui:2021:ELM,% Karpov:2021:HSM,% Li:2023:FIS,% Temel:2023:PAM,% Anders:2023:CBH,% Dobrovolskiy:2023:TDS,% Karpov:2021:HSM,% McCutcheon:2023:AMC,% Minenkov:2023:ICB,% Morera-Boado:2023:IEC,% Saito:2020:SIMa,% Saito:2020:SIMb,% Salta:2022:DCT,% Tian:2020:MDM% }. \NAMECITE{{O}-compounds}{% Minenkov:2023:ICB% }. \NAMECITE{{O-H}}{% Karpov:2021:HSM% }. \NAMECITE{Obelin}{% Griffiths:2020:AIP% }. \NAMECITE{obtain}{% Fujimoto:2021:MRO% }. \NAMECITE{obtained}{% Usler:2023:GES% }. \NAMECITE{{OC}}{% Haritha:2023:HBO% }. \NAMECITE{occupation}{% Aquino:2020:FON,% Scheiner:2022:MOB,% Sulka:2021:FNO% }. \NAMECITE{occupied}{% Kramer:2023:ESD% }. \NAMECITE{{OCOH}}{% deCarvalho:2020:VTS% }. \NAMECITE{octamer}{% Balasubramanian:2020:NWO% }. \NAMECITE{octanol}{% Sun:2023:DTHa% }. \NAMECITE{{OCTMCCO}}{% Li:2023:FIS% }. \NAMECITE{O\doublebond}{% Afonin:2022:MTA% }. \NAMECITE{off}{% Leskourova:2022:ECH% }. \NAMECITE{off-center}{% Leskourova:2022:ECH% }. \NAMECITE{offs}{% Wilson:2022:ARI% }. \NAMECITE{oligonucleotides}{% Kelich:2023:BPS% }. \NAMECITE{Omicron}{% Kim:2023:BHA% }. \NAMECITE{on-surface}{% Luy:2023:BCI% }. \NAMECITE{on-the-fly}{% Ootani:2020:TFM,% Rappoport:2023:LMO% }. \NAMECITE{one}{% Blasiak:2021:IEO,% Wu:2023:DKS% }. \NAMECITE{one-electron}{% Blasiak:2021:IEO% }. \NAMECITE{one-step}{% Wu:2023:DKS% }. \NAMECITE{online}{% Wassenaar:2022:ZST% }. \NAMECITE{onto}{% Anders:2023:CBH% }. \NAMECITE{{OO}}{% Salta:2022:DCT% }. \NAMECITE{open}{% Abbasi:2022:COS,% Flachsenberg:2021:LOS,% Hanasaki:2023:IRT,% Martinez-Nunez:2021:AOS,% Prasanna:2021:DOS,% Rappoport:2023:LMO% }. \NAMECITE{open-source}{% Abbasi:2022:COS,% Flachsenberg:2021:LOS,% Hanasaki:2023:IRT,% Martinez-Nunez:2021:AOS,% Prasanna:2021:DOS,% Rappoport:2023:LMO% }. \NAMECITE{Opening}{% Verma:2020:MIS% }. \NAMECITE{operators}{% Blasiak:2021:IEO,% Corzo:2022:UPO% }. \NAMECITE{{OPLS}}{% Zhang:2022:TCS% }. \NAMECITE{{OPLS-AA}}{% Zhang:2022:TCS% }. \NAMECITE{oppositely}{% Hernandez:2020:AIM% }. \NAMECITE{optical}{% Bae:2022:TDD,% Benchehaima:2022:NOP,% Jager:2021:VOP,% Jharapla:2021:CDS,% Ligorio:2023:BBD,% Steglenko:2020:SEO,% Toutounji:2021:ESD% }. \NAMECITE{optically}{% Tashiro:2021:NGO% }. \NAMECITE{Optimal}{% Wu:2020:DOC,% Yang:2020:ODP,% Search:2022:TOB% }. \NAMECITE{Optimization}{% Laghuvarapu:2020:BND,% Medves:2022:ODF,% Sieradzan:2023:OPI,% Andreadi:2022:TPE,% Corzo:2022:UPO,% Ma:2023:MLA,% Matyszczak:2021:AAN,% Mrovec:2021:DFO,% Mukhopadhyay:2020:ENR,% Nair:2021:RAO,% Pascale:2022:SOS,% Perron:2022:DGM,% Stuart:2020:PBW,% Sun:2023:DTHb,% Trepte:2022:DDC% }. \NAMECITE{optimizations}{% Geiger:2022:AIS,% Mashkovtsev:2020:EMI% }. \NAMECITE{Optimized}{% Gallmetzer:2022:PRA% }. \NAMECITE{optimizing}{% Rezende:2023:ABG% }. \NAMECITE{optoelectronic}{% Al-Qaisi:2023:TIL,% Zheng:2020:ACC% }. \NAMECITE{orbit}{% Pech:2020:QCT,% Piotrowski:2022:AVW% }. \NAMECITE{Orbital}{% Alzahrani:2020:CAI,% Boruah:2020:PRS,% Kusumoto:2020:SIA,% Laplaza:2021:OEN,% Speelman:2021:ECS,% Akinaga:2020:FSC,% Aquino:2020:FON,% Ciancaleoni:2020:DOH,% Fedorov:2022:PEF,% Garcia-Rates:2021:ISD,% Hirao:2020:EEE,% Kido:2023:CHL,% Kramer:2023:ESD,% Nakamura:2023:STA,% Nelson:2020:LLO,% Patel:2020:DBL,% Scheiner:2022:RAM,% Sulka:2021:FNO,% Takaba:2022:PLB,% Tsuneda:2023:ROE% }. \NAMECITE{orbital-based}{% Takaba:2022:PLB% }. \NAMECITE{orbitals}{% Benedek:2022:SCC,% Forster:2020:DHD,% Kasper:2020:NTO,% Miyamoto:2020:SER% }. \NAMECITE{order}{% Casals-Sainz:2020:EII,% Doi:2021:SLO,% Eidi:2021:HOH,% Fujimori:2021:EBA,% Fukuhara:2023:IPR,% Gu:2020:EKT,% Hoffmann:2021:DES,% Qian:2022:PWO,% Sanchez:2020:CIS,% Yu:2020:DHD% }. \NAMECITE{Organic}{% Laghuvarapu:2020:BND,% Andreadi:2022:TPE,% Fouda:2020:IPQ,% Ghalami:2020:AST,% Hidalgo-Rosa:2020:SME,% Kar:2021:AFA,% Karton:2021:EDF,% Kramer:2023:ESD,% Lazaric:2023:SFE,% Luy:2021:EHM,% Martinez-Araya:2021:DPR,% Modee:2022:BSD,% Nguyen:2022:BCC,% Sharma:2022:BDF,% Su:2020:IHH,% Taouali:2023:DFT,% Tashiro:2021:NGO,% Tsuneda:2023:ROE,% Waldrop:2020:ICC,% Zheng:2020:ACC% }. \NAMECITE{organic-inorganic}{% Kar:2021:AFA,% Su:2020:IHH% }. \NAMECITE{organocatalysts}{% Faizan:2022:BBI% }. \NAMECITE{organophosphorus}{% Tian:2020:MDM% }. \NAMECITE{orientation}{% Koliogiorgos:2023:ETB,% Robertson:2021:SPO,% Simko:2022:QCP% }. \NAMECITE{oriented}{% Garcia:2021:POB,% Nakov:2021:PAA% }. \NAMECITE{Origin}{% Evarestov:2020:OPI,% Mishima:2023:OKH,% Pooja:2023:OSS,% Reitz:2023:AOP,% Simone:2022:OPA% }. \NAMECITE{Origins}{% Jiang:2020:MSU,% Taouali:2023:DFT% }. \NAMECITE{ortho}{% Voros:2023:ESO% }. \NAMECITE{ortho-nitrobenzaldehyde}{% Voros:2023:ESO% }. \NAMECITE{orthogonal}{% Ciancaleoni:2020:DOH% }. \NAMECITE{oscillators}{% Bandyopadhyay:2023:MCG% }. \NAMECITE{Other}{% Fiorin:2020:DDF,% Tehrani:2023:ITA% }. \NAMECITE{overlap}{% Corzo:2022:UPO% }. \NAMECITE{Overlapping}{% Rublev:2023:OED% }. \NAMECITE{{Overreact}}{% Schneider:2023:OSL% }. \NAMECITE{Oversampling}{% Ngo:2020:OFE% }. \NAMECITE{oxa}{% Nacereddine:2021:CIS% }. \NAMECITE{oxa-{Diels}}{% Nacereddine:2021:CIS% }. \NAMECITE{Oxidation}{% Cao:2020:DFS,% Kanamaru:2022:FAE,% Lu:2023:HOS,% Menzel:2021:EWI,% Priyadarsini:2021:CFP% }. \NAMECITE{oxidative}{% Ishioka:2021:UGP,% Kirschbaum:2022:EOA% }. \NAMECITE{oxide}{% Ali:2022:MSC,% Muz:2022:ZON,% Reitz:2023:AOP,% Tian:2020:MDM% }. \NAMECITE{oxides}{% Rahali:2023:HII% }. \NAMECITE{Oxidized}{% Cao:2020:DFS% }. \NAMECITE{{oxidozirconium}}{% Choudhary:2022:DFT% }. \NAMECITE{oxindoles}{% Somnarin:2023:CIR% }. \NAMECITE{oxo}{% Maraf:2022:DRM,% Martinez-Araya:2021:DPR% }. \NAMECITE{{OxoMn}}{% Ma:2021:IES% }. \NAMECITE{Oxygen}{% Griffiths:2020:AIP,% Han:2020:CAS,% Nair:2021:RAO% }. \NAMECITE{oxygen-oxygen}{% Han:2020:CAS% }. \NAMECITE{oxynitride}{% Henkel:2021:UEC% }. \NAMECITE{p}{% Abdullayev:2022:CMS,% Fukal:2022:AMM,% Hussain:2020:IBT,% Ignatchenko:2023:SPS,% Sabater:2023:CSE,% Sulzner:2022:PAP% }. \NAMECITE{p-phenylenediamine}{% Abdullayev:2022:CMS% }. \NAMECITE{{P}-surface}{% Ignatchenko:2023:SPS% }. \NAMECITE{package}{% Andreadi:2021:PSS,% Cao:2023:ESP,% Hanasaki:2023:IRT,% Kelich:2023:BPS,% Kumar:2020:FSP,% Lee:2021:PPB,% Ma:2020:PPP,% Sieradzan:2023:OPI,% Valencia:2021:NDG,% Yuan:2022:PPP% }. \NAMECITE{packet}{% Saito:2020:SIMb% }. \NAMECITE{Paddlewheel}{% Alzahrani:2020:CAI% }. \NAMECITE{Pair}{% Savoo:2020:ASA,% Garcia-Rates:2021:ISD,% Hernandez:2020:AIM,% Patel:2020:DBL,% Qi:2020:CGD,% Zhang:2022:RTR% }. \NAMECITE{pairs}{% Faizan:2022:BBI,% Tupikina:2020:LPM% }. \NAMECITE{pairwise}{% Yang:2020:ODP% }. \NAMECITE{para}{% Safi:2021:BCP% }. \NAMECITE{para-substituted}{% Safi:2021:BCP% }. \NAMECITE{{ParaCopasi}}{% Yuan:2022:PPP% }. \NAMECITE{parallel}{% Alcaide:2022:MNM,% Brabec:2021:MPQ,% Chevreau:2023:PIP,% Gupta:2022:EHD,% Jung:2021:NPC,% Jung:2023:AGR,% Sieradzan:2023:OPI,% Wang:2020:PPC,% Yuan:2022:PPP% }. \NAMECITE{parallelization}{% Nishimura:2020:HPD,% Yang:2020:EME% }. \NAMECITE{parallelized}{% Andoh:2021:AMM% }. \NAMECITE{parameter}{% Piotrowski:2022:AVW,% Roe:2022:PAT% 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Song:2023:CAR% }. \NAMECITE{pathway}{% Dubey:2023:IFM,% Han:2020:CAS,% Pramanik:2022:MIK% }. \NAMECITE{pathways}{% Banik:2020:QMS,% Campetella:2020:FEE,% Ding:2020:EEP% }. \NAMECITE{patterns}{% Haritha:2022:HPR,% Kim:2023:BHA% }. \NAMECITE{Pb}{% Liu:2022:GES% }. \NAMECITE{PbI}{% Xi:2021:TDS% }. \NAMECITE{{PBSA}}{% Sun:2023:DTHa,% Sun:2023:DTHb% }. \NAMECITE{{PCM}}{% Cammi:2022:SDE% }. \NAMECITE{{Pd}}{% Ahmadvand:2020:TPP,% Parambath:2023:DQB% }. \NAMECITE{{Pd-PEPPSI}}{% Ahmadvand:2020:TPP% }. \NAMECITE{{PDB}}{% Roe:2022:PAT% }. \NAMECITE{{PDB}-to-parameter}{% Roe:2022:PAT% }. \NAMECITE{{PdBe}}{% Tzeli:2021:QCB% }. \NAMECITE{{PEACH}}{% Zhang:2021:FEM% }. \NAMECITE{penicillin}{% Cheng:2020:ADM% }. \NAMECITE{pentacoordinate}{% Freindorf:2022:CBH% }. \NAMECITE{pentahalides}{% Pomogaeva:2021:ISL% }. \NAMECITE{{Pep}}{% Schuhmann:2021:IPM% }. \NAMECITE{{PepPro}}{% Xu:2020:PNS% }. \NAMECITE{{PEPPSI}}{% Ahmadvand:2020:TPP% }. \NAMECITE{peptidase}{% Cheng:2020:ADM% }. \NAMECITE{Peptide}{% Xu:2020:PNS,% Efaz:2021:RFI,% Gkogka:2022:FMD,% Kelich:2023:BPS,% Schuhmann:2021:IPM,% Stylianakis:2020:BBS,% Uddin:2023:LSP% }. \NAMECITE{peptide-based}{% Kelich:2023:BPS% }. \NAMECITE{Peptide-Protein}{% Xu:2020:PNS% }. \NAMECITE{per-}{% Melin:2023:TPP% }. \NAMECITE{perfluorinated}{% Fan:2023:SSP% }. \NAMECITE{perfluoroalkyl}{% Mifkovic:2022:CDH% }. \NAMECITE{perform}{% Cao:2023:ESP% }. \NAMECITE{Performance}{% Boruah:2020:PRS,% Ghiami-Shomami:2023:PCS,% Narsaria:2020:PTV,% Petrus:2020:PGA,% Bayati:2020:HPT,% Larsson:2020:MTC,% Macedo:2022:PEC,% Mandal:2022:ISP,% Ohno:2021:HPG,% Santos:2021:CBH,% Temel:2023:PAM% }. \NAMECITE{performed}{% Martinez-Araya:2021:DPR% }. \NAMECITE{Performing}{% Zaczek:2020:MSF,% Fukuhara:2023:IPR% }. \NAMECITE{period}{% Laun:2021:BCC,% Laun:2022:BCC% }. \NAMECITE{Periodic}{% Sadhu:2020:PTC,% Hanasaki:2023:IRT,% Popov:2021:LPP,% Prasad:2021:EES,% Su:2020:IHH,% Yoshii:2020:FMM% }. \NAMECITE{permeability}{% Zhang:2020:MMP% }. \NAMECITE{permutation}{% Fukuhara:2023:IPR% }. \NAMECITE{Permutationally}{% Omodemi:2022:PIP% }. \NAMECITE{perovskite}{% Su:2020:IHH,% Xi:2021:TDS% }. \NAMECITE{perovskites}{% Al-Qaisi:2023:TIL,% Ali:2023:SEM,% Kar:2021:AFA,% deAraujo:2023:HCN% }. \NAMECITE{peroxide}{% Chen:2023:DSC,% Dong:2021:DHP% }. \NAMECITE{peroxides}{% McCutcheon:2023:AMC,% Wu:2023:DKS% }. \NAMECITE{peroxy}{% Wu:2023:DKS% }. \NAMECITE{persistent}{% Bedford:2021:NPI% }. \NAMECITE{perspective}{% Arroyuelo:2021:EQP,% Boziki:2022:TPU,% Dare:2022:CRQ,% Levina:2022:KET,% Levina:2023:DPC,% Nguyen:2022:BCC,% Ponte:2020:MPR,% Saito:2020:SIMb,% Simko:2022:QCP% }. \NAMECITE{persulfate}{% Abdullayev:2022:CMS% }. \NAMECITE{Perturbation}{% Ngo:2020:OFE,% Alaidi:2020:SMP,% Fujimori:2021:EBA,% Gu:2020:EKT,% Miyamoto:2020:SER,% Nanayakkara:2021:CEN,% Orangi:2020:FLA,% Sanchez:2020:CIS,% Yang:2020:ODP% }. \NAMECITE{perturbations}{% Popov:2021:LPP% }. \NAMECITE{perturbed}{% Pascale:2023:HDC% }. \NAMECITE{{PFAS}}{% Mifkovic:2022:CPP% }. 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Li:2020:HVH% }. \NAMECITE{R-C}{% Li:2020:HVH% }. \NAMECITE{{R61}}{% Cheng:2020:ADM% }. \NAMECITE{{Rabenstein}}{% Madabeni:2020:CMB% }. \NAMECITE{radial}{% Chenouf:2020:EEC% }. \NAMECITE{radical}{% Gerhards:2023:MSR,% Muhasina:2023:VRT,% Per:2020:RRS,% Somnarin:2023:CIR% }. \NAMECITE{radical-mediated}{% Somnarin:2023:CIR% }. \NAMECITE{radicals}{% Wu:2023:DKS% }. \NAMECITE{radii}{% Sun:2023:DTHb% }. \NAMECITE{radiolysis}{% Andreadi:2021:PSS% }. \NAMECITE{{Raman}}{% Carvalho:2022:CAR,% Gentile:2020:SCD,% Miyamoto:2020:SER,% Platonenko:2021:ICD% }. \NAMECITE{Random}{% Haase:2020:NDC,% Vilela:2020:PDZ,% Yu:2020:DHD% }. \NAMECITE{Range}{% Boruah:2020:PRS,% Ahn:2021:ALR,% Cao:2021:PIL,% Gallmetzer:2022:PRA,% Geindre:2021:NLR,% Higo:2021:GEM,% Hirao:2020:EEE% }. \NAMECITE{ranking}{% Pham:2022:ILR% }. \NAMECITE{{Raphson}}{% Mukhopadhyay:2020:ENR% }. \NAMECITE{{Raphson}/singular}{% Mukhopadhyay:2020:ENR% }. \NAMECITE{rapid}{% Li:2023:SRE,% Mukhopadhyay:2020:ENR% }. \NAMECITE{rare}{% Riccardi:2020:PID,% Roussey:2023:QQS% }. \NAMECITE{{Ras}}{% Marcus:2020:WRS% }. \NAMECITE{Rashba}{% deAraujo:2023:HCN% }. \NAMECITE{rate}{% deCarvalho:2020:VTS% }. \NAMECITE{rates}{% Carreon-Gonzalez:2022:CRD% }. \NAMECITE{Rational}{% Dutta:2021:RDP,% Sun:2023:RDI,% Zhang:2021:RDN,% Zhang:2023:CRD% }. \NAMECITE{ray}{% Ehlert:2020:PPP,% Fouda:2020:IPQ% }. \NAMECITE{Rb}{% Sousa:2020:ASS,% Al-Qaisi:2023:TIL,% Rolfes:2020:AES% }. \NAMECITE{{RBD}}{% Kim:2023:BHA% }. \NAMECITE{{RC\triplebond}}{% Wang:2020:MSE% }. \NAMECITE{{RDFE}}{% Macchiagodena:2023:RPT% }. \NAMECITE{R\doublebond}{% Wang:2020:MSE% }. \NAMECITE{Reaction}{% Quapp:2020:SMR,% Savoo:2020:ASA,% Ali:2022:MSC,% Bai:2021:FRD,% Banik:2020:QMS,% Bruce-Chwatt:2022:MMR,% Campetella:2020:FEE,% Chamkin:2020:DDC,% Cheng:2020:ADM,% Cuesta:2021:CSR,% Ding:2020:EEP,% Dong:2022:PXB,% Dong:2023:EZL,% Geiger:2022:AIS,% Han:2020:CAS,% Hernandez-Rodriguez:2020:MSS,% Li:2022:BCM,% Liu:2022:DQM,% Long:2022:ERP,% Mancera:2020:DAR,% Maraf:2022:DRM,% Martinez-Nunez:2021:AOS,% Mitsuta:2023:NES,% Nair:2021:RAO,% Paiva:2020:AVD,% Priyadarsini:2021:CFP,% Schmitz:2021:AWM,% Sebesta:2020:QQM,% Somnarin:2023:CIR,% Sugiyama:2021:RRN,% Sun:2021:REF,% Tian:2020:MDM,% Yarish:2023:AMG,% Zhang:2022:ARM,% Zhang:2022:RTR% }. \NAMECITE{Reactions}{% Ohno:2020:QCE,% Smith:2020:KTR,% Ahmadvand:2020:TPP,% Gallegos:2022:RSP,% Luy:2023:BCI,% Macedo:2022:PEC,% Madabeni:2020:CMB,% Mandal:2020:ECF,% Paiva:2020:AVD,% Raucci:2020:EDB,% Schmitz:2021:AWM,% Schneider:2023:OSL,% Sobhi:2023:UMR,% Spotte-Smith:2020:ADA,% Waite:2021:TSG,% deCarvalho:2020:VTS% }. \NAMECITE{Reactive}{% Tsuneda:2023:ROE,% Bertolini:2022:VEC,% Friis:2020:MEI,% Zhang:2021:REF% }. \NAMECITE{Reactivities}{% Ma:2023:RSC% }. \NAMECITE{Reactivity}{% Stuyver:2020:TCM,% Vijayalakshmi:2020:ECR,% Choudhary:2022:DFT,% Gorantla:2022:UHR,% Klein:2021:NIC,% Lamine:2022:TER,% Luy:2021:EHM,% Martinez-Araya:2022:ASC,% Zhang:2022:RTR% }. \NAMECITE{reading}{% Verstraelen:2021:IPL% }. \NAMECITE{reagents}{% Sun:2021:REF% }. \NAMECITE{Real}{% Muller:2020:RTT,% Gallegos:2022:RSP,% Hanasaki:2023:IRT,% Korsaye:2022:FDE% }. \NAMECITE{Real-time}{% Muller:2020:RTT,% Hanasaki:2023:IRT% }. \NAMECITE{Realistic}{% Inoue:2023:RNC,% Zhang:2022:TCS% }. \NAMECITE{reality}{% Martino:2020:CPE% }. \NAMECITE{Realization}{% Sugita:2023:RSF% }. \NAMECITE{Rearrangement}{% Perumalla:2023:RDM% }. \NAMECITE{reason}{% Rublev:2023:OED% }. \NAMECITE{Reasoning}{% Quapp:2020:SMR% }. \NAMECITE{Receptor}{% Bhattarai:2020:GPC,% Beck:2021:UIH,% BenSaid:2021:ENS,% Chinnasamy:2020:IBM,% Tosso:2020:CES,% Tosso:2022:ECS,% Vankayala:2022:PCN,% Waschenbach:2020:DEG% }. \NAMECITE{receptor-}{% Chinnasamy:2020:IBM% }. \NAMECITE{receptor-flexible}{% Vankayala:2022:PCN% }. \NAMECITE{Receptor-Membrane}{% Bhattarai:2020:GPC% }. \NAMECITE{Receptors}{% Minh:2020:AGD% }. \NAMECITE{recognition}{% Bai:2022:SGS,% Beck:2021:UIH,% Devillers:2020:CDP,% Kwapien:2021:IIE,% Sun:2021:EMB,% Wang:2023:MBR% }. \NAMECITE{Recognizing}{% Hu:2020:RFM% }. \NAMECITE{reconstruction}{% Alcaide:2022:MNM,% Pal:2021:MFB% }. \NAMECITE{reconstructions}{% ODonnell:2023:GCW% }. \NAMECITE{Record}{% Hou:2020:RAS% }. \NAMECITE{Recovering}{% Rapallo:2021:EDT% }. \NAMECITE{recovery}{% Dobrovolskiy:2023:TDS% }. \NAMECITE{rectangular}{% Andoh:2020:EFM% }. \NAMECITE{recurrence}{% Gao:2020:GRR,% Inoue:2023:AQM% }. \NAMECITE{recurrence-relation}{% Gao:2020:GRR% }. \NAMECITE{recurrent}{% Tashiro:2021:NGO% }. \NAMECITE{Redox}{% Rastetter:2023:RAL,% Maley:2023:DFT,% Rasspe-Lange:2023:GBA,% Serdtsev:2022:ESS% }. \NAMECITE{Redox-active}{% Rastetter:2023:RAL% }. \NAMECITE{reductase}{% Campos-Fernandez:2022:IND% }. \NAMECITE{Reduction}{% Ahmadvand:2020:TPP,% Ananthaneni:2020:CST,% Nair:2021:RAO,% Ponte:2020:MPR% }. \NAMECITE{reference}{% Benedek:2022:SCC,% Kanemaru:2023:SEF,% Voros:2023:ESO,% Wilson:2022:ARI% }. \NAMECITE{Refined}{% Kondo:2021:RMT% }. \NAMECITE{refinement}{% Nakov:2021:PAA,% Ramm:2021:EMR% }. \NAMECITE{regime}{% Fregoni:2020:PSC% }. \NAMECITE{regio}{% Sobhi:2023:UMR% }. \NAMECITE{regio-}{% Sobhi:2023:UMR% }. \NAMECITE{region}{% Fujimori:2021:EBA% }. \NAMECITE{Regioselective}{% Jiang:2020:MSU% }. \NAMECITE{Regioselectivity}{% Jiang:2020:MSU% }. \NAMECITE{regression}{% Burn:2022:PCA,% Omodemi:2022:PIP,% Schmitz:2023:ARG% }. \NAMECITE{regularized}{% Schmitz:2023:ARG% }. \NAMECITE{regulating}{% Pramanik:2022:MIK,% Wang:2020:LCD% }. \NAMECITE{regulator}{% Chan:2021:MSM% }. \NAMECITE{reinforcement}{% Jiang:2022:CRD% }. \NAMECITE{related}{% Bai:2022:SGS,% Casier:2021:HLG,% Maley:2023:DFT% }. \NAMECITE{relation}{% Gao:2020:GRR% }. \NAMECITE{relationship}{% Haritha:2022:HPR% }. \NAMECITE{relationships}{% Ma:2023:RSC% }. \NAMECITE{relative}{% Macchiagodena:2023:RPT,% Peng:2020:APR% }. \NAMECITE{Relativistic}{% Gusmao:2022:RAG,% Kanemaru:2023:SEF,% Munoz-Castro:2022:BCN,% Rolfes:2020:AES,% Sadhu:2020:PTC% }. \NAMECITE{relaxation}{% Gerhards:2023:MSR% }. \NAMECITE{release}{% Ghalami:2020:AST,% Gieseking:2021:NRM,% Pakdel:2020:ESA% }. \NAMECITE{relevant}{% Dare:2022:CRQ,% Gorantla:2023:SBC% }. \NAMECITE{Reliability}{% Zhang:2022:RCM,% Scheiner:2022:RAM% }. \NAMECITE{Reliable}{% Per:2020:RRS,% Ahirwar:2023:FFM,% Chan:2022:ADC% }. \NAMECITE{REMD}{% Marcisz:2022:ESR% }. \NAMECITE{removal}{% Fujimoto:2021:MRO% }. \NAMECITE{renormalization}{% Brabec:2021:MPQ,% Tran:2020:ESN,% Xie:2023:KID% }. \NAMECITE{repair}{% Carreon-Gonzalez:2022:CRD% }. \NAMECITE{Replacement}{% Zheng:2020:MSIb,% Zheng:2020:MSIa% }. \NAMECITE{replica}{% Fukuhara:2023:IPR,% Jung:2023:AGR,% Kapakayala:2021:BCS,% Marcisz:2022:ESR,% Maszota-Zieleniak:2021:ERE,% Raubenolt:2022:SSP,% Siebenmorgen:2020:PPP% }. \NAMECITE{replicas}{% Song:2023:CAR% }. \NAMECITE{repositioning}{% Sixto-Lopez:2021:DRT% }. \NAMECITE{Representation}{% Wu:2020:DOC,% Bayati:2020:HPT,% Dare:2022:CRQ,% Omodemi:2022:PIP% }. \NAMECITE{Representations}{% Balasubramanian:2020:CCH,% Shepard:2020:RSG,% Chilkuri:2021:CMP% }. \NAMECITE{repulsion}{% Kiani:2021:MLE% }. \NAMECITE{repulsion-corrected}{% Kiani:2021:MLE% }. \NAMECITE{repulsive}{% Marcisz:2022:ESR,% Maszota-Zieleniak:2021:ERE,% Siebenmorgen:2020:PPP% }. \NAMECITE{repurposed}{% Pramanik:2022:MIK% }. \NAMECITE{Repurposing}{% Efaz:2021:RFI% }. \NAMECITE{residue}{% Bai:2022:SGS% }. \NAMECITE{residues}{% Muthusivarajan:2020:RAR% }. \NAMECITE{resistance}{% Brankin:2022:PAR% }. \NAMECITE{resolution}{% Lee:2023:BAM% }. \NAMECITE{resolved}{% Ahn:2021:ALR,% Avagliano:2022:API,% Cerezo:2023:FVR% }. \NAMECITE{Resolving}{% Xu:2020:RPA% }. \NAMECITE{Resonance}{% Weinhold:2021:CSW,% Afonin:2020:QDR,% Afonin:2022:MTA,% Lubecka:2021:EAE,% Nakatani:2021:AVE,% Wang:2021:RCS,% Wang:2021:SWD% }. \NAMECITE{resonance-assisted}{% Afonin:2020:QDR,% Afonin:2022:MTA% }. \NAMECITE{resonances}{% Bai:2021:FRD% }. \NAMECITE{resource}{% Lian:2020:AMD% }. \NAMECITE{respect}{% Cammi:2022:SDE% }. \NAMECITE{Response}{% Wang:2021:RCS,% Cammi:2022:SDE,% Toutounji:2021:ESD% }. \NAMECITE{responsive}{% Khelashvili:2020:MLB% }. \NAMECITE{Restoring}{% Wu:2021:AHP% }. \NAMECITE{restrained}{% Qi:2020:CGD% }. \NAMECITE{restrained-ensemble}{% Qi:2020:CGD% }. \NAMECITE{Restraints}{% Menzer:2020:REP% }. \NAMECITE{Results}{% Bates:2021:CIB,% Stsiapura:2020:SEE% }. \NAMECITE{revealed}{% Luy:2023:BCI% }. \NAMECITE{revealing}{% Afonin:2022:MTA% }. \NAMECITE{reveals}{% Bedford:2021:NPI,% Hernandez-Rodriguez:2020:MSS,% Joseph:2020:MDA,% Martinez-Araya:2021:DPR,% Omotuyi:2020:ASR% }. \NAMECITE{Review}{% Zhou:2020:RCI% }. \NAMECITE{revisited}{% Nash:2023:CCA,% Pal:2023:EIR,% Saito:2020:SIMa,% Tupikina:2021:EFH% }. \NAMECITE{Revisiting}{% Morin-Martinez:2023:QBA,% Sun:2021:REF% }. \NAMECITE{{RhB}}{% Tzeli:2021:QCB% }. \NAMECITE{rheology}{% Nourian:2023:IPR% }. \NAMECITE{Rhodopsins}{% Hernandez-Rodriguez:2020:MSS% }. \NAMECITE{riboswitches}{% Alaidi:2020:SMP% }. \NAMECITE{ribozyme}{% Joseph:2020:MDA% }. \NAMECITE{rich}{% Jharapla:2021:CDS,% Sun:2021:EMB% }. \NAMECITE{{Riemann}}{% Mitsuta:2023:CWN% }. \NAMECITE{right}{% Sun:2021:REF% }. \NAMECITE{Rigid}{% Minh:2020:AGD,% Weiser:2023:SBP% }. \NAMECITE{Ring}{% Lin:2020:IMC,% Alonso-Gil:2021:PMS,% Jablonski:2022:PNU,% Kong:2022:MPR% }. \NAMECITE{rings}{% Haritha:2022:HPR,% Haritha:2023:HBO% }. \NAMECITE{{RISM}}{% Cao:2023:ESP,% Yoshidome:2020:CRA% }. \NAMECITE{{RL}}{% Jiang:2022:CRD% }. \NAMECITE{Rn}{% Arrue:2021:SCB% }. \NAMECITE{{RNA}}{% Alaidi:2020:SMP,% Kalathingal:2023:MMB,% Sun:2021:EMB,% Tanida:2020:AFE,% Wang:2023:MBR,% Yuan:2021:MEH% }. \NAMECITE{robust}{% Nguyen:2021:PLE% }. \NAMECITE{Role}{% Matsuoka:2020:RTT,% Muthusivarajan:2020:RAR,% Nair:2021:RAO,% Byun:2023:CRK,% Frazee:2021:IIP,% Gallegos:2022:RSP,% Karachi:2023:BHS,% Levina:2021:ERE,% Munoz-Castro:2022:BCN,% Sanchez-Gonzalez:2022:ICH,% Zhang:2021:REF,% Zhou:2022:TMP% }. \NAMECITE{roles}{% Vega:2020:GGA% }. \NAMECITE{rotamers}{% Pagola:2021:PAG% }. \NAMECITE{rotating}{% Yu:2023:TLM% }. \NAMECITE{rotation}{% Koput:2022:GSP% }. \NAMECITE{rotational}{% Prasad:2021:EES% }. \NAMECITE{rotors}{% Yu:2023:TLM% }. \NAMECITE{route}{% Sugiyama:2021:RRN% }. \NAMECITE{{Roux}}{% Im:2020:CBR% }. \NAMECITE{rovibrational}{% Schneider:2023:QCR% }. \NAMECITE{RS}{% Marcisz:2022:ESR,% Sulzner:2022:PAP,% Vijayalakshmi:2020:ECR% }. \NAMECITE{RS-REMD}{% Marcisz:2022:ESR% }. \NAMECITE{Ru}{% Hokmi:2021:CSN,% Cocic:2022:IWS% }. \NAMECITE{rubber}{% Ma:2023:RSC% }. \NAMECITE{{RuBisCO}}{% Douglas-Gallardo:2020:ESB,% Jiang:2020:TAK% }. \NAMECITE{{RuC}}{% Tzeli:2021:QCB% }. \NAMECITE{rule}{% Tolstykh:2022:UCA,% Tupikina:2021:EFH% }. \NAMECITE{rung}{% Ramos:2021:DFF% }. \NAMECITE{rung-3.5}{% Ramos:2021:DFF% }. \NAMECITE{ruthenium}{% Kido:2023:CHL,% Yoshida:2020:ELS% }. \NAMECITE{rutile}{% Valdes:2020:TSA% }. \NAMECITE{S}{% Domnin:2020:FPC,% Gallegos:2022:RSP,% Gieseking:2021:NRM,% Savoo:2020:ASA,% Patel:2020:PPL% }. \NAMECITE{{SA}}{% Stsiapura:2020:SEE% }. \NAMECITE{{SA-2-CASSCF}}{% Stsiapura:2020:SEE% }. \NAMECITE{saddle}{% Macedo:2022:PEC% }. \NAMECITE{safe}{% Joseph:2020:MDA% }. \NAMECITE{salts}{% Jharapla:2021:CDS% }. \NAMECITE{same}{% Sanchez:2020:CIS% }. \NAMECITE{same-spin}{% Sanchez:2020:CIS% }. \NAMECITE{Sampling}{% Fiorin:2020:DDF,% Roussey:2023:QQS,% Aaroen:2021:PVA,% Fukuhara:2023:IPR,% Gupta:2022:EHD,% Kapakayala:2021:BCS,% Kondo:2021:RMT,% Liu:2021:AAS,% Ngo:2021:ELB,% Pal:2021:MFB,% Schieschke:2021:GDE,% Sebesta:2020:QQM,% Simm:2020:SMA,% Wu:2023:ESE,% Zhang:2020:FUT,% Zhao:2023:GSA% }. \NAMECITE{sandwich}{% Anila:2023:FMS,% Kohn:2023:CSG% }. \NAMECITE{{SARS}}{% Efaz:2021:RFI,% Kim:2023:BHA,% Omotuyi:2020:ASR,% Panthi:2023:AAS,% PhD:2021:INI,% Pramanik:2022:MIK,% Sixto-Lopez:2021:DRT,% Uddin:2023:LSP,% You:2023:EIM% }. \NAMECITE{{SARS-CoV-}}{% Sixto-Lopez:2021:DRT% }. \NAMECITE{{SARS-COV-2}}{% Omotuyi:2020:ASR,% Efaz:2021:RFI,% Kim:2023:BHA,% Panthi:2023:AAS,% PhD:2021:INI,% Pramanik:2022:MIK,% You:2023:EIM% }. \NAMECITE{save}{% Pechlaner:2021:UMT% }. \NAMECITE{scalar}{% Rolfes:2020:AES% }. 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Chen:2020:SCC,% Corzo:2022:UPO,% Stachowicz-Kusnierz:2020:CDM% }. \NAMECITE{self-diffusion}{% Baba:2022:PSD% }. \NAMECITE{self-interaction}{% Aquino:2020:FON% }. \NAMECITE{semi}{% Kong:2022:MPR,% Peng:2020:APR,% Rasspe-Lange:2023:GBA,% Trepte:2022:DDC% }. \NAMECITE{semi-empirical}{% Kong:2022:MPR,% Peng:2020:APR,% Rasspe-Lange:2023:GBA% }. \NAMECITE{semi-local}{% Trepte:2022:DDC% }. \NAMECITE{semiclassical}{% Fatkova:2023:VEE% }. \NAMECITE{semiconducting}{% Chenouf:2020:EEC,% Kramer:2023:ESD,% Li:2021:TNS% }. \NAMECITE{semiconductor}{% Luy:2021:EHM,% Wang:2022:SEE,% Zheng:2020:ACC% }. \NAMECITE{Semiempirical}{% Grillo:2020:SMD,% Gieseking:2021:NRM% }. \NAMECITE{Sensing}{% Hidalgo-Rosa:2020:SME% }. \NAMECITE{Sensitivity}{% Benedek:2022:SCC,% Lefrancois-Gagnon:2020:TUS% }. \NAMECITE{sensitizers}{% Lopez-Carballeira:2021:NPI% }. \NAMECITE{sensor}{% Zarate:2020:DMA% }. \NAMECITE{sensors}{% Muz:2022:ZON% }. \NAMECITE{Separated}{% Boruah:2020:PRS% }. \NAMECITE{Separation}{% Nag:2022:SHM,% Wakchaure:2020:PBB,% Yuan:2021:JDF% }. \NAMECITE{{SEQCROW}}{% Schaefer:2021:SCB% }. \NAMECITE{sequence}{% Kelich:2023:BPS,% Kotowski:2021:PEA,% Salgado-Blanco:2023:EMP% }. \NAMECITE{sequence-based}{% Kotowski:2021:PEA% }. \NAMECITE{sequential}{% Ghalami:2020:AST% }. \NAMECITE{series}{% BenSaid:2021:ENS,% Peng:2020:APR% }. \NAMECITE{server}{% Lian:2020:AMD,% Malik:2020:HWS,% Feltes:2023:NSV% }. \NAMECITE{serving}{% Tsuneda:2023:ROE% }. \NAMECITE{Set}{% Xu:2020:PNS,% Ye:2020:FBS,% Baek:2022:DSF,% Karton:2021:EDF,% Minenkov:2023:ICB,% Speelman:2021:ECS,% Tehrani:2023:ITA% }. \NAMECITE{sets}{% Garcia:2021:POB,% Gusmao:2022:RAG,% Laun:2021:BCC,% Laun:2022:BCC,% Nash:2023:CCA,% Rolfes:2020:AES,% Seidler:2023:BCC,% Semidalas:2022:AGC% }. \NAMECITE{setup}{% Cardenas:2023:MTS% }. \NAMECITE{seven}{% Kacka-Zych:2022:MAS% }. \NAMECITE{seven-membered}{% Kacka-Zych:2022:MAS% }. \NAMECITE{sextet}{% Tolstykh:2022:UCA% }. \NAMECITE{{sH}}{% Mondal:2023:SSS% }. \NAMECITE{{Sham}}{% Benedek:2022:SCC,% Ehlert:2020:PPP,% Hirao:2020:EEE,% Mrovec:2021:DFO% }. \NAMECITE{shape}{% Kurisaki:2023:TCC% }. \NAMECITE{{SHARK}}{% Neese:2023:SIG% }. \NAMECITE{{Shavitt}}{% Shepard:2020:RSG% }. \NAMECITE{sheets}{% Schmitz:2023:ARG% }. \NAMECITE{shell}{% Andreadi:2021:PSS,% Kloo:2022:CSI,% Mrovec:2021:DFO,% Sanchez:2020:CIS,% Prasad:2021:EES% }. \NAMECITE{shift}{% Fukal:2022:AMM,% Tupikina:2020:LPM,% Unzueta:2020:PCM% }. \NAMECITE{shifts}{% Benassi:2022:IDF,% Mifkovic:2022:CPP,% Zahn:2021:BDF% }. \NAMECITE{shock}{% Bekker:2020:ESC,% Friis:2020:MEI% }. \NAMECITE{short}{% Higo:2021:GEM,% Sarmah:2022:HSC% }. \NAMECITE{short-range}{% Higo:2021:GEM% }. \NAMECITE{Si}{% Gorantla:2021:SGE,% Wang:2022:SEE,% Koliogiorgos:2023:ETB,% Valdes:2023:CCI% }. \NAMECITE{side}{% Benchehaima:2022:NOP,% Orabi:2020:DPF,% Stylianakis:2020:BBS% }. \NAMECITE{side-chain}{% Stylianakis:2020:BBS% }. \NAMECITE{signaling}{% Chan:2021:MSM% }. \NAMECITE{silaboryne}{% Das:2023:BSE% }. \NAMECITE{silane}{% Ma:2023:RSC% }. 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Burn:2022:PCA,% Chan:2021:MSM,% Chinnasamy:2020:IBM,% Crowet:2021:LDD,% Fujimoto:2021:MRO,% Gkogka:2022:FMD,% Hernandez-Rodriguez:2020:MSS,% Hirakawa:2020:BME,% Kaiser:2020:MCS,% Katsyuba:2022:CAS,% Kognole:2022:PCG,% Nam:2023:SSP,% Nourian:2023:IPR,% Omotuyi:2020:ASR,% PhD:2021:INI,% Rajasekhar:2021:EPI,% Schmitz:2021:AWM,% Segatta:2021:ISI,% Shimoyama:2021:ADF,% Shu:2022:PFI,% Sun:2021:EMB,% Usler:2023:GES,% Valencia:2021:NDG,% You:2023:EIM,% Yuan:2022:PPP,% Zhang:2021:FEM% }. \NAMECITE{simulation-based}{% Chan:2021:MSM% }. \NAMECITE{Simulations}{% Sakae:2020:APB,% Zaczek:2020:MSF,% Baba:2022:PSD,% Diem:2020:EDC,% Ehlert:2020:PPP,% Fatkova:2023:VEE,% Freites:2023:ISD,% Ghalami:2020:AST,% Hayashi:2023:PAD,% Jung:2023:AGR,% Lai:2021:NGC,% Larsson:2020:MTC,% Lipska:2023:LTS,% Liu:2021:AAS,% Mendanha:2021:MDS,% Mollahosseini:2022:EMI,% Ngo:2021:ELB,% Nishimura:2020:HPD,% Nourian:2023:IPR,% Panthi:2023:AAS,% Parkman:2021:CNP,% Pechlaner:2021:MAB,% Pechlaner:2021:UMT,% Poleto:2022:TEF,% Porwal:2023:HEV,% Qi:2020:CGD,% Rajasekhar:2022:INI,% Rapallo:2021:EDT,% Schneider:2023:OSL,% Sieradzan:2023:OPI,% Stachowicz-Kusnierz:2020:CDM,% Temel:2023:PAM,% Terteci-Popescu:2022:BPC,% Tikhonov:2023:MSB,% Wang:2023:MBR,% Waschenbach:2020:DEG,% Wieder:2022:AFE,% Wu:2021:AHP,% Zhao:2023:GSA% }. \NAMECITE{Simultaneous}{% Goncalves:2022:SPT,% Blanc:2023:PLM,% Wang:2023:CPL% }. \NAMECITE{single}{% Alipour:2020:ABS,% Badorrek:2022:CSN,% Chenouf:2020:EEC,% Dong:2023:EZL,% Eidi:2021:HOH,% Geiger:2022:AIS,% Kotowski:2021:PEA,% Voros:2023:ESO% }. \NAMECITE{single-}{% Voros:2023:ESO% }. \NAMECITE{single-electron}{% Eidi:2021:HOH% }. \NAMECITE{single-ended}{% Geiger:2022:AIS% }. \NAMECITE{single-molecule}{% Alipour:2020:ABS% }. \NAMECITE{single-walled}{% Badorrek:2022:CSN,% Chenouf:2020:EEC% }. \NAMECITE{single/dual}{% Dong:2023:EZL% }. \NAMECITE{single/dual-atom}{% Dong:2023:EZL% }. \NAMECITE{Singlet}{% Haase:2020:NDC,% Fatkova:2023:VEE,% Lopez-Carballeira:2021:NPI,% Milanez:2023:SSL,% Speelman:2021:ECS% }. \NAMECITE{singular}{% Mukhopadhyay:2020:ENR% }. \NAMECITE{Site}{% Verma:2020:MIS,% Banik:2020:QMS,% Chan:2021:MSM,% Cho:2023:CIE,% Devillers:2020:CDP,% Kanemaru:2023:SEF,% Kwapien:2021:IIE,% Pan:2020:TSF,% Tosso:2022:ECS,% Wilson:2022:ARI% }. \NAMECITE{site-specific}{% Cho:2023:CIE% }. \NAMECITE{sites}{% Hu:2020:RFM,% Larsson:2020:MTC,% Melse:2023:BBF,% Yoshidome:2020:CRA% }. \NAMECITE{{Si\triplebond}}{% Das:2023:BSE% }. \NAMECITE{situ}{% Wu:2023:DKS% }. \NAMECITE{situation}{% Fernandez:2022:BSI% }. \NAMECITE{situations}{% Thomas-Hargreaves:2023:BST% }. \NAMECITE{six}{% Parambath:2023:DQB% }. \NAMECITE{six-electron}{% Parambath:2023:DQB% }. \NAMECITE{sixth}{% Laun:2021:BCC% }. \NAMECITE{size}{% Gusmao:2022:RAG,% Harding:2020:IMS,% Jager:2021:VOP,% Koliogiorgos:2023:ETB,% Long:2022:ERP,% Sabater:2023:CSE,% Xie:2020:SMP% }. \NAMECITE{size-modified}{% Xie:2020:SMP% }. \NAMECITE{Sized}{% Malloum:2020:LSA,% Barcza:2022:CAI,% Zeng:2020:SNS% }. \NAMECITE{slab}{% Valdes:2020:TSA% }. \NAMECITE{{Slater}}{% Dang:2022:NES,% Forster:2020:DHD,% Medves:2022:ODF% }. \NAMECITE{{Slater}-type}{% Medves:2022:ODF% }. \NAMECITE{sliced}{% Gupta:2022:EHD,% Kapakayala:2021:BCS,% Pal:2021:MFB% }. \NAMECITE{slip}{% Wu:2021:AHP% }. \NAMECITE{slip-springs}{% Wu:2021:AHP% }. \NAMECITE{{Sm}}{% Arabzadeh:2022:HDL% }. \NAMECITE{Small}{% Laghuvarapu:2020:BND,% Milovanovic:2021:SLC,% Gusmao:2022:RAG,% Jager:2021:VOP,% Kumar:2020:FSP,% Lazaric:2023:SFE,% Modee:2022:BSD,% Nhat:2020:EBM,% Shekarappa:2023:DML,% Tashiro:2021:NGO,% Walker:2022:AAP,% Yoshidome:2020:CRA,% Zarnecka:2023:FUF,% Zeng:2020:SNS% }. \NAMECITE{small-molecule}{% Zarnecka:2023:FUF% }. \NAMECITE{small-sized}{% Zeng:2020:SNS% }. \NAMECITE{Smoothed}{% Garcia-Jacas:2020:SST% }. \NAMECITE{Sn}{% Liu:2022:GES% }. \NAMECITE{sodium}{% Nash:2023:CCA,% Serdtsev:2022:ESS% }. \NAMECITE{softness}{% Martinez-Araya:2022:ASC% }. \NAMECITE{Software}{% Kosenkov:2022:PSE,% Zaczek:2020:MSF,% Alonso-Gil:2021:PMS,% Andreadi:2021:PSS,% Cao:2023:ESP,% Chen:2021:CLS,% Chirico:2021:PQC,% DeFever:2021:MCC,% Garcia-Jacas:2020:DMQ,% Hanasaki:2023:IRT,% Lourenco:2023:GGA,% Mao:2021:EIG,% Rappoport:2023:LMO,% Segatta:2021:ISI% }. \NAMECITE{solar}{% Su:2020:IHH,% Taouali:2023:DFT% }. \NAMECITE{Solid}{% Tchougreeff:2021:SSQ,% Eisele:2020:MMK,% Henkel:2021:UEC,% Laun:2021:BCC,% Laun:2022:BCC,% Li:2023:FIS,% Seidler:2023:BCC,% Usler:2023:GES% }. \NAMECITE{Solid-state}{% Tchougreeff:2021:SSQ,% Laun:2021:BCC,% Laun:2022:BCC,% Seidler:2023:BCC,% Usler:2023:GES% }. \NAMECITE{solids}{% Casier:2021:HLG% }. \NAMECITE{solubility}{% Freites:2023:ISD% }. \NAMECITE{Solute}{% Garcia-Rates:2020:ESC,% Jung:2023:AGR,% Kapakayala:2021:BCS,% Zhao:2023:GSA% }. \NAMECITE{solution}{% Katsyuba:2022:CAS,% Kido:2023:CHL,% Kurisaki:2023:TCC,% Mendanha:2021:MDS,% Raucci:2020:IMD,% Sugita:2023:RSF% }. \NAMECITE{solutions}{% Kondo:2021:MSD,% Kondo:2021:RMT,% Sebesta:2020:QQM% }. \NAMECITE{solvated}{% Ligorio:2023:BBD,% Monti:2022:CAM% 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Martinez-Araya:2022:ASC% }. \NAMECITE{sorbitol}{% Kondo:2021:MSD% }. \NAMECITE{source}{% Abbasi:2022:COS,% Flachsenberg:2021:LOS,% Hanasaki:2023:IRT,% Martinez-Nunez:2021:AOS,% Prasanna:2021:DOS,% Rappoport:2023:LMO% }. \NAMECITE{sp}{% Akinaga:2020:FSC,% PhD:2021:INI% }. \NAMECITE{space}{% Bekker:2020:ESC,% Gallegos:2022:RSP,% Han:2020:CAS,% Kelich:2023:BPS,% Mathea:2022:AVC,% Ramos-Sanchez:2023:AMG,% Schieschke:2021:GDE,% Tosso:2022:ECS% }. \NAMECITE{Sparse}{% Bai:2022:SGS% }. \NAMECITE{speciation}{% Lian:2020:AMD% }. \NAMECITE{species}{% Xie:2020:SMP% }. \NAMECITE{specific}{% Cho:2023:CIE,% Walter:2021:MML,% Zhao:2023:GSA% }. \NAMECITE{Spectra}{% Cao:2020:DFS,% Cerezo:2023:FVR,% Ehlert:2020:PPP,% Gentile:2020:SCD,% Katsyuba:2022:CAS,% Luise:2021:MUV,% Platonenko:2021:ICD,% Segatta:2021:ISI,% Tirri:2021:CMC% }. \NAMECITE{spectral}{% Luise:2022:MSP% }. \NAMECITE{spectroscopic}{% Li:2023:FIS% }. \NAMECITE{Spectroscopy}{% Bader:2020:VCM,% Choudhary:2022:DFT,% Fouda:2020:IPQ,% 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\NAMECITE{Steric}{% Verma:2020:MIS,% Gallegos:2022:RSP% }. \NAMECITE{stiffness}{% Mitsuta:2023:NES% }. \NAMECITE{stochastic}{% Solovyov:2022:MMS% }. \NAMECITE{stone}{% Contreras-Torres:2020:DCD% }. \NAMECITE{stone-wales}{% Contreras-Torres:2020:DCD% }. \NAMECITE{storage}{% Sarmah:2022:HSC,% Spotte-Smith:2020:ADA,% Wakchaure:2020:PBB% }. \NAMECITE{Strain}{% Savoo:2020:ASA,% Merzoud:2021:UID% }. \NAMECITE{strains}{% Lipska:2023:LTS% }. \NAMECITE{Strategies}{% Pascale:2022:SOS,% Pinto:2021:MCP,% Sorbelli:2022:ENB% }. \NAMECITE{strategy}{% Hayes:2021:SPG% }. \NAMECITE{streamline}{% Parkman:2021:CNP% }. \NAMECITE{strength}{% Castor-Villegas:2020:SHB,% Fan:2023:SSP,% Malcek:2020:CBD,% Nanayakkara:2021:CEN% }. \NAMECITE{{Streptomyces}}{% Cheng:2020:ADM% }. \NAMECITE{stretching}{% Geindre:2021:NLR% }. \NAMECITE{strong}{% Fregoni:2020:PSC% }. \NAMECITE{strontium}{% Khajehpasha:2021:NST% }. \NAMECITE{Structural}{% Ali:2023:SEM,% Choudhuri:2020:SBB,% Milanez:2023:SSL,% Pecoraro:2020:SEP,% 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\NAMECITE{{TABI}}{% Wilson:2021:CMN% }. \NAMECITE{table}{% Gangopadhyay:2021:ANP% }. \NAMECITE{TaH}{% Wang:2020:MSE% }. \NAMECITE{tailoring}{% Afonin:2020:QDR,% Afonin:2022:GTC,% Afonin:2022:MTA% }. \NAMECITE{Taking}{% Gomez:2022:TMC% }. \NAMECITE{tangential}{% Chenouf:2020:EEC% }. \NAMECITE{target}{% Kalathingal:2023:MMB,% Sixto-Lopez:2021:DRT% }. \NAMECITE{targets}{% Brankin:2022:PAR% }. \NAMECITE{{TATA}}{% Salgado-Blanco:2023:EMP% }. \NAMECITE{{TATA-DNA}}{% Salgado-Blanco:2023:EMP% }. \NAMECITE{tautomeric}{% Curtolo:2022:MPT% }. \NAMECITE{tautomerism}{% Levina:2022:KET% }. \NAMECITE{Tautomerization}{% Nakatani:2021:AVE% }. \NAMECITE{{TBP}}{% Wang:2023:MBR% }. \NAMECITE{{TcN}}{% Tzeli:2021:QCB% }. \NAMECITE{{TD}}{% Avagliano:2022:API,% Dobrovolskiy:2023:TDS,% Luise:2022:MSP,% Mendanha:2021:MDS,% Muz:2022:ZON,% Wang:2020:HAT% }. \NAMECITE{{TD-DFT}}{% Avagliano:2022:API,% Dobrovolskiy:2023:TDS,% Luise:2022:MSP,% Mendanha:2021:MDS,% Muz:2022:ZON% }. \NAMECITE{{TDDFT}}{% 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\NAMECITE{tricoordinated}{% Thomas-Hargreaves:2023:BST% }. \NAMECITE{tricresyl}{% Hayashi:2023:PAD% }. \NAMECITE{trifluoro}{% Sobhi:2023:UMR% }. \NAMECITE{trimeric}{% Panthi:2023:AAS% }. \NAMECITE{trimethylphosphine}{% Chamkin:2020:DDC% }. \NAMECITE{trioxides}{% Khakimov:2022:TTC% }. \NAMECITE{tripeptide}{% ODonnell:2023:GCW% }. \NAMECITE{tripeptides}{% ODonnell:2023:GCW% }. \NAMECITE{triphosphate}{% Xiong:2022:CBP% }. \NAMECITE{triple}{% Doi:2021:SLO,% Laun:2021:BCC,% Laun:2022:BCC,% Seidler:2023:BCC,% Zhang:2021:CPC% }. \NAMECITE{triple-zeta}{% Laun:2021:BCC,% Laun:2022:BCC,% Seidler:2023:BCC% }. \NAMECITE{Triplet}{% Haase:2020:NDC,% Milanez:2023:SSL% }. \NAMECITE{tris}{% Anjali:2020:AEP,% Munoz-Castro:2022:BCN% }. \NAMECITE{tropolone}{% Ootani:2020:TFM% }. \NAMECITE{truncated}{% Garcia-Jacas:2020:DMQ% }. \NAMECITE{Truncation}{% Garcia-Jacas:2020:SST,% Nakamura:2023:STA% }. \NAMECITE{tryptophane}{% Carreon-Gonzalez:2022:CRD% }. \NAMECITE{tuberculosis}{% Rajasekhar:2021:EPI,% 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\NAMECITE{utilizing}{% Hoffmann:2021:DES% }. \NAMECITE{{UV}}{% Cao:2020:DFS,% Luise:2021:MUV,% Tirri:2021:CMC% }. \NAMECITE{{UV-Vis}}{% Cao:2020:DFS,% Luise:2021:MUV,% Tirri:2021:CMC% }. \NAMECITE{V}{% Ma:2021:IES% }. \NAMECITE{{v2.0}}{% Garcia-Jacas:2020:DMQ% }. \NAMECITE{Valence}{% Bertolini:2022:VEC,% Ciancaleoni:2020:DOH,% Laun:2021:BCC,% Laun:2022:BCC,% Nakatani:2021:AVE,% Pascale:2023:HDC,% Salta:2022:DCT,% Seidler:2023:BCC,% Xu:2020:RPA% }. \NAMECITE{Validation}{% Bader:2020:VCM,% Devillers:2020:CDP,% Wu:2020:DOC,% Laplaza:2021:OEN% }. \NAMECITE{validations}{% Gresh:2021:MCP,% Kwapien:2021:IIE% }. \NAMECITE{validity}{% Paiva:2020:AVD% }. \NAMECITE{value}{% Mukhopadhyay:2020:ENR% }. \NAMECITE{values}{% Sulzner:2022:PAP% }. \NAMECITE{Vanadium}{% Stahl:2020:CAD% }. \NAMECITE{{van't}}{% Zheng:2020:MSIa,% Zheng:2020:MSIb% }. \NAMECITE{variability}{% Yang:2020:ODP% }. \NAMECITE{variant}{% Ali:2023:SEM% }. \NAMECITE{variants}{% Kim:2023:BHA% }. \NAMECITE{Variation}{% Jager:2021:VOP,% Haghshenas:2021:DVQ% }. \NAMECITE{Variational}{% deCarvalho:2020:VTS,% Gusmao:2022:RAG% }. \NAMECITE{Variations}{% Fiorin:2020:DDF% }. \NAMECITE{varying}{% Dey:2023:APP% }. \NAMECITE{{VASP}}{% Valencia:2021:NDG% }. \NAMECITE{{VEGF}}{% Kalathingal:2023:MMB% }. \NAMECITE{versatile}{% Feltes:2023:NSV% }. \NAMECITE{version}{% Chirico:2021:PQC,% DiGrande:2023:ATA% }. \NAMECITE{Versus}{% Li:2020:HVH,% Mondal:2023:SSS,% Muhasina:2023:VRT,% Nguyen:2022:TMT,% Schmitt:2023:TEC% }. \NAMECITE{Vertical}{% Narsaria:2020:PTV,% Fatkova:2023:VEE% }. \NAMECITE{via}{% Afonin:2022:GTC,% Ali:2023:SEM,% Ciancaleoni:2020:DOH,% Ignatchenko:2023:SPS,% Ishioka:2021:UGP,% Kacka-Zych:2022:MAS,% Ngo:2021:ELB,% Patel:2020:PPL,% Rajasekhar:2021:EPI,% Summa:2023:CFD,% Tanida:2020:AFE% }. \NAMECITE{vibration}{% Koput:2022:GSP% }. \NAMECITE{vibration-rotation}{% Koput:2022:GSP% }. \NAMECITE{vibrational}{% Carvalho:2022:CAR,% Freindorf:2022:CBH,% Jharapla:2021:CDS,% Mathea:2021:AVC,% Mathea:2022:AVC,% Porwal:2023:HEV,% Shiga:2022:PIB% }. \NAMECITE{Vibrationally}{% Cerezo:2023:FVR,% Ahn:2021:ALR% }. \NAMECITE{Vibrationally-resolved}{% Cerezo:2023:FVR% }. \NAMECITE{vibronic}{% Toutounji:2021:ESD% }. \NAMECITE{view}{% Perumalla:2023:RDM% }. \NAMECITE{viewpoint}{% Nakatani:2021:AVE% }. \NAMECITE{viewpoints}{% Merzoud:2021:UID% }. \NAMECITE{{VIM}}{% Kwapien:2021:IIE% }. \NAMECITE{{VIM-2}}{% Kwapien:2021:IIE% }. \NAMECITE{{Vina}}{% Pham:2022:ILR% }. \NAMECITE{viral}{% Gkogka:2022:FMD% }. \NAMECITE{virtual}{% Larsson:2020:MTC,% Mao:2021:EIG,% Martino:2020:CPE% }. \NAMECITE{Virus}{% Kusumoto:2020:SIA,% Lipska:2023:LTS,% Malik:2020:HWS% }. \NAMECITE{virus-like}{% Lipska:2023:LTS% }. \NAMECITE{vis}{% Tirri:2021:CMC,% Cao:2020:DFS,% Luise:2021:MUV% }. \NAMECITE{visual}{% Lu:2022:IGM% }. \NAMECITE{Visualization}{% Aaroen:2021:PVA% }. \NAMECITE{voltage}{% Xie:2020:SMP% }. \NAMECITE{voltage-dependent}{% Xie:2020:SMP% }. \NAMECITE{Volume}{% Anonymous:2020:CIVa,% Anonymous:2020:CIVb,% Anonymous:2020:CIVba,% Anonymous:2020:CIVbb,% Anonymous:2020:CIVc,% Anonymous:2020:CIVd,% Anonymous:2020:CIVe,% Anonymous:2020:CIVf,% Anonymous:2020:CIVg,% Anonymous:2020:CIVh,% Anonymous:2020:CIVi,% Anonymous:2020:CIVj,% Anonymous:2020:CIVk,% Anonymous:2020:CIVl,% Anonymous:2020:CIVm,% Anonymous:2020:CIVo,% Anonymous:2020:CIVp,% Anonymous:2020:CIVq,% Anonymous:2020:CIVr,% Anonymous:2020:CIVs,% Anonymous:2020:CIVt,% Anonymous:2020:CIVu,% Anonymous:2020:CIVv,% Anonymous:2020:CIVw,% Anonymous:2020:CIVx,% Anonymous:2020:CIVy,% Anonymous:2020:CIVz,% Gong:2020:AGB,% Raucci:2020:CIV% }. \NAMECITE{volumes}{% Barletta:2022:ACC% }. \NAMECITE{{Voronoi}}{% Nieuwland:2023:UCS% }. \NAMECITE{{W1X}}{% Chan:2022:ADC% }. \NAMECITE{{Waals}}{% Bandyopadhyay:2023:MCG,% Evarestov:2020:OPI,% Piotrowski:2022:AVW,% Yu:2020:DHD% }. \NAMECITE{wales}{% Contreras-Torres:2020:DCD% }. \NAMECITE{walled}{% Badorrek:2022:CSN,% Chenouf:2020:EEC% }. \NAMECITE{Water}{% Hughes:2020:FWM,% Marcus:2020:WRS,% Balasubramanian:2020:NWO,% Bruce-Chwatt:2022:MMR,% Castor-Villegas:2020:SHB,% Cocic:2022:IWS,% Doi:2021:SLO,% Dong:2021:DHP,% Ghiami-Shomami:2023:PCS,% Gresh:2021:MCP,% Krog:2023:MCA,% Li:2023:SRE,% Mendanha:2021:MDS,% Menzel:2021:EWI,% Pan:2020:TSF,% Priyadarsini:2021:CFP,% Raucci:2020:IMD,% Sun:2023:DTHa,% Valdes:2023:CCI,% Vyboishchikov:2021:FNI,% Yoshida:2020:ELS% }. \NAMECITE{waters}{% Zhou:2022:TMP% }. \NAMECITE{wave}{% Carvalho:2022:CAR,% Nelson:2020:LLO,% Saito:2020:SIMb,% Wang:2020:PPC% }. \NAMECITE{wavefunction}{% Stuart:2020:PBW% }. \NAMECITE{wavefunctions}{% Ammar:2020:FCW% }. \NAMECITE{Waves}{% Weinhold:2021:CSW,% Friis:2020:MEI,% Mandal:2020:ECF,% Wang:2021:RCS,% Wang:2021:SWD% }. \NAMECITE{weakly}{% Brzeski:2023:ABL% }. \NAMECITE{web}{% Lian:2020:AMD,% Malik:2020:HWS% }. \NAMECITE{weighted}{% Garcia-Jacas:2020:DMQ,% Minenkov:2023:ICB,% Mitsuta:2023:CWN,% Mukhopadhyay:2020:ENR,% Roussey:2023:QQS% }. \NAMECITE{weighted-core}{% Minenkov:2023:ICB% }. \NAMECITE{well}{% Kapakayala:2021:BCS% }. \NAMECITE{well-sliced}{% Kapakayala:2021:BCS% }. \NAMECITE{whether}{% Ahn:2020:PWA% }. \NAMECITE{Which}{% Wang:2021:RCS,% Wang:2021:SWD,% Weinhold:2021:CSW% }. \NAMECITE{wide}{% Bates:2021:CIB% }. \NAMECITE{wild}{% Chinnasamy:2020:IBM% }. \NAMECITE{wires}{% Azizi:2020:NGQ,% Lu:2023:SMW% }. \NAMECITE{{Withania}}{% PhD:2021:INI% }. \NAMECITE{Within}{% Shepard:2020:RSG,% Castor-Villegas:2020:SHB,% Cervinka:2022:TQH,% Garcia-Rates:2020:ESC,% Inamori:2020:SFA,% Jana:2020:ESB,% ODonnell:2023:GCW,% Patel:2020:DBL,% Sobhi:2023:UMR% }. \NAMECITE{without}{% Wieder:2022:AFE,% Wu:2023:DKS% }. \NAMECITE{word}{% Qian:2022:PWO% }. \NAMECITE{work}{% Casanova-Paez:2021:GDH,% Zhang:2020:FUT% }. \NAMECITE{workflow}{% Menzel:2021:EWI,% Schmitz:2021:AWM% }. \NAMECITE{would}{% Ahn:2020:PWA% }. \NAMECITE{writing}{% Verstraelen:2021:IPL% }. \NAMECITE{X}{% Arrue:2021:SCB,% Simko:2022:QCP,% Luise:2022:MSP,% Al-Qaisi:2023:TIL,% Ali:2023:SEM,% Ehlert:2020:PPP,% Fouda:2020:IPQ,% Koput:2022:ICA,% Sun:2023:RDI,% Tupikina:2021:EFH% }. \NAMECITE{x-phenylenediamine}{% Luise:2022:MSP% }. \NAMECITE{{X}-ray}{% Ehlert:2020:PPP,% Fouda:2020:IPQ% }. \NAMECITE{XCl}{% Al-Qaisi:2023:TIL% }. \NAMECITE{{Xe}}{% Rolfes:2020:AES% }. \NAMECITE{{XEDA}}{% Tang:2021:XFM% }. \NAMECITE{xenon}{% Gusmao:2022:RAG% }. \NAMECITE{{XGBoost}}{% Dong:2022:PXB% }. \NAMECITE{{XGBoost}-based}{% Dong:2022:PXB% }. \NAMECITE{{XP}}{% Cammi:2022:SDE% }. \NAMECITE{{XP-PCM}}{% Cammi:2022:SDE% }. \NAMECITE{{xTB}}{% Menzel:2021:EWI,% Otlyotov:2022:CEM% }. \NAMECITE{{YF}}{% Anders:2023:CBH% }. \NAMECITE{yield}{% Dong:2022:PXB% }. \NAMECITE{yields}{% Somnarin:2023:CIR,% Tortorella:2021:CML,% Yarish:2023:AMG% }. \NAMECITE{yl}{% Maraf:2022:DRM% }. \NAMECITE{ylide}{% Sobhi:2023:UMR% }. \NAMECITE{zeolite}{% Nag:2022:SHM% }. \NAMECITE{zeta}{% Laun:2021:BCC,% Laun:2022:BCC,% Seidler:2023:BCC% }. \NAMECITE{{Ziff}}{% Vilela:2020:PDZ% }. \NAMECITE{zigzag}{% Shao:2021:LCA% }. \NAMECITE{Zinc}{% Muz:2022:ZON,% Yu:2023:TLM% }. \NAMECITE{{Zintl}}{% Liu:2022:GES% }. \NAMECITE{zirconocene}{% Maley:2023:DFT% }. \NAMECITE{{Zn}}{% Borah:2022:SZG,% Gresh:2021:MCP,% Melse:2023:BBF% }. \NAMECITE{{ZnO}}{% Gutsev:2020:IBD% }. \NAMECITE{{Zr}}{% Domnin:2020:FPC% }. \NAMECITE{{ZrS}}{% Dong:2023:EZL% }. \NAMECITE{zwitterionic}{% Lourenco:2021:MDS,% Mendanha:2021:MDS% }. \NAMECITE{{ZZS}}{% Wassenaar:2022:ZST% }.