Last update: Sun Jun 2 02:01:03 MDT 2019
Top |
Symbols |
Math |
A |
B |
C |
D |
E |
F |
G |
H |
I |
J |
K |
L |
M |
N |
O |
P |
Q |
R |
S |
T |
U |
V |
W |
X |
Y |
Z
BibTeX entry
@Article{Radmer:1997:FEC,
author = "Randall J. Radmer and Peter A. Kollman",
title = "Free energy calculation methods: a theoretical and
empirical comparison of numerical errors and a new
method qualitative estimates of free energy changes",
journal = j-J-COMPUT-CHEM,
volume = "18",
number = "7",
pages = "902--919",
month = may,
year = "1997",
CODEN = "JCCHDD",
DOI = "https://doi.org/10.1002/(SICI)1096-987X(199705)18:7<902::AID-JCC4>3.0.CO;2-V",
ISSN = "0192-8651 (print), 1096-987X (electronic)",
ISSN-L = "0192-8651",
bibdate = "Thu Nov 29 15:11:14 MST 2012",
bibsource = "http://www.interscience.wiley.com/jpages/0192-8651;
http://www.math.utah.edu/pub/tex/bib/jcomputchem1990.bib",
acknowledgement = ack-nhfb,
fjournal = "Journal of Computational Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0192-8651",
onlinedate = "7 Dec 1998",
}
Related entries
- change,
13(3)362,
15(9)981,
16(12)1474,
20(11)1091
- comparison,
11(1)32,
11(2)159,
11(4)541,
11(4)543,
11(9)1021,
12(1)52,
12(1)119,
12(2)172,
12(2)200,
12(3)292,
12(4)417,
12(6)742,
12(8)959,
12(9)1134,
13(1)41,
13(4)525,
13(5)640,
13(7)793,
14(1)75,
14(4)401,
14(4)438,
14(4)478,
14(5)620,
14(6)736,
14(7)790,
14(8)899,
14(8)922,
14(9)1085,
14(9)1101,
14(10)1149,
14(11)1281,
14(12)1498,
14(12)1504,
15(1)12,
15(8)875,
15(10)1176,
15(11)1228,
16(3)385,
16(6)777,
16(8)973,
16(9)1067,
16(12)1543,
16(12)1554,
17(2)185,
17(2)250,
17(4)429,
17(7)841,
17(7)888,
17(9)1142,
17(11)1296,
17(13)1508,
17(14)1653,
17(15)1696,
17(15)1757,
18(1)108,
18(1)115,
18(2)169,
18(4)449,
18(4)562,
18(7)920,
18(8)1011,
18(8)1043,
18(8)1072,
18(9)1136,
18(13)1609,
19(3)308,
19(4)377,
19(11)1294,
19(14)1596,
20(2)244,
20(2)274,
20(4)383,
20(11)1177,
20(12)1299,
20(13)1329,
20(13)1343,
20(13)1379
- empirical,
11(5)654,
11(10)1125,
12(1)9,
13(3)257,
14(2)138,
14(4)379,
14(5)510,
16(5)595,
16(5)610,
16(8)951,
17(5)616,
17(7)790,
17(7)841,
17(12)1406,
18(1)28,
18(4)533,
18(9)1136,
19(3)334,
19(13)1515,
19(14)1639
- error,
11(8)930,
12(6)697,
16(9)1120,
17(8)962,
17(16)1836,
18(9)1113,
19(8)833,
19(11)1229,
20(2)274,
20(14)1537
- estimate,
14(5)620
- free,
11(1)76,
11(4)511,
11(8)994,
12(1)42,
12(2)271,
12(7)899,
12(10)1165,
12(10)1232,
13(3)362,
13(4)429,
13(5)541,
13(5)651,
13(5)667,
13(9)1057,
14(5)620,
14(10)1240,
14(12)1498,
15(1)105,
15(2)149,
15(3)333,
15(3)351,
15(7)704,
15(11)1241,
16(3)370,
16(9)1131,
16(11)1420,
16(12)1513,
17(2)148,
17(3)273,
17(9)1112,
17(9)1156,
17(14)1587,
17(15)1726,
18(4)449,
18(10)1320,
19(7)769,
19(8)977,
19(11)1229,
19(11)1278,
19(13)1494,
19(14)1639,
19(15)1724,
19(15)1736,
19(16)1853,
20(5)499,
20(8)749,
20(8)877,
20(10)1018,
20(10)1028,
20(15)1604,
20(15)1644
- Kollman, Peter A.,
11(4)431,
11(8)994,
12(5)620,
13(1)33,
13(3)362,
13(4)525,
13(8)952,
13(8)963,
13(8)971,
13(8)1011,
14(3)295,
14(3)312,
15(3)351,
16(2)243,
16(9)1164,
16(11)1339,
16(11)1351,
16(11)1357,
16(12)1483,
17(9)1112,
17(13)1541,
18(13)1632
- new,
11(2)265,
11(2)266,
11(3)410,
11(5)545,
11(5)603,
11(6)694,
11(9)1101,
12(1)139,
12(3)410,
12(5)527,
12(6)664,
12(8)981,
13(2)187,
13(2)254,
13(2)254,
13(3)371,
13(4)539,
13(6)792,
13(10)1199,
13(10)1216,
14(5)587,
14(9)1036,
14(9)1077,
14(9)1101,
14(10)1184,
14(10)1212,
14(11)1333,
15(1)105,
15(5)488,
15(5)524,
15(7)667,
15(8)814,
15(10)1127,
16(1)20,
16(3)311,
16(8)923,
16(9)1170,
17(3)326,
17(4)476,
17(9)1132,
17(12)1406,
17(14)1645,
17(14)1667,
18(4)594,
18(5)646,
18(6)744,
18(9)1113,
18(9)1222,
18(10)1295,
19(6)673,
19(8)866,
19(14)1663,
19(15)1758,
19(16)1805,
20(7)665,
20(10)1067
- numerical,
11(2)194,
12(5)560,
13(2)135,
13(3)275,
14(7)775,
14(12)1519,
15(1)72,
15(5)507,
16(3)273,
16(3)337,
16(12)1507,
17(8)962,
17(8)970,
18(7)920,
18(13)1591,
20(7)655
- theoretical,
11(3)269,
11(3)291,
11(4)524,
11(7)896,
11(9)1017,
11(10)1119,
12(1)135,
12(7)862,
12(9)1134,
12(10)1211,
13(6)681,
13(6)722,
13(7)821,
13(8)919,
13(8)935,
13(9)1047,
13(10)1184,
14(4)471,
14(4)478,
14(5)587,
14(6)699,
14(8)913,
14(12)1545,
14(12)1575,
15(5)479,
15(10)1176,
16(4)465,
16(6)659,
16(9)1131,
17(2)133,
17(3)289,
17(7)835,
17(10)1245,
17(13)1520,
17(16)1804,
18(1)56,
18(1)108,
18(13)1647,
18(16)2012,
18(16)2075,
19(2)113,
19(2)240,
19(3)277,
19(8)912,
19(9)989,
19(12)1325,
19(14)1584,
19(15)1675,
19(16)1795,
19(16)1816,
19(16)1826,
20(12)1254,
20(13)1412