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BibTeX entry
@Article{Carballeira:1990:DAM,
author = "L. Carballeira and A. J. Pereiras and M. A. Rios",
title = "Design and application of a molecular mechanics force
field for alkyl iodides including an electrostatic
polarization model",
journal = j-J-COMPUT-CHEM,
volume = "11",
number = "6",
pages = "734--742",
month = jul,
year = "1990",
CODEN = "JCCHDD",
DOI = "https://doi.org/10.1002/jcc.540110606",
ISSN = "0192-8651 (print), 1096-987X (electronic)",
ISSN-L = "0192-8651",
bibdate = "Thu Nov 29 14:54:11 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 Sep 2004",
}
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- alkyl,
11(8)958,
11(10)1119,
12(9)1047,
14(7)755,
15(2)162,
15(3)283,
15(3)333
- application,
0(0)xix--393,
11(1)19,
11(5)576,
11(5)603,
11(6)680,
11(7)819,
11(8)978,
11(8)994,
11(9)1061,
11(10)1139,
12(3)342,
12(8)1008,
12(10)1223,
13(1)93,
13(2)229,
13(3)329,
13(4)539,
13(8)979,
14(1)37,
14(3)253,
14(5)566,
14(6)647,
14(8)977,
14(8)986,
14(9)1019,
14(9)1066,
14(11)1301,
14(12)1429,
14(12)1482,
15(4)433,
15(5)488,
15(5)532,
15(6)588,
15(7)704,
15(8)814,
15(9)1041,
15(10)1139,
15(12)1372,
16(1)1,
16(1)80,
16(1)105,
16(2)154,
16(3)370,
16(3)378,
16(5)648,
16(8)1011,
16(9)1141,
16(11)1357,
16(12)1474,
17(2)226,
17(3)267,
17(8)940,
17(8)1056,
17(12)1444,
17(13)1541,
17(14)1653,
18(1)1,
18(2)260,
18(2)290,
18(4)463,
18(4)522,
18(5)638,
18(6)723,
18(8)1004,
18(12)1450,
18(14)1750,
18(14)1812,
19(1)60,
19(6)628,
20(1)70,
20(1)155,
20(3)287,
20(4)396,
20(6)572,
20(8)749,
20(9)911,
20(11)1153,
20(14)1495,
20(15)1644,
20(15)1671
- design,
11(2)181,
15(2)233,
15(5)488,
15(12)1393,
16(9)1120,
18(15)1943,
20(2)185,
20(2)284,
42(0)399
- electrostatic,
11(1)112,
11(2)159,
11(3)297,
11(3)346,
11(3)361,
11(3)401,
11(4)416,
11(8)909,
11(9)1038,
11(9)1080,
12(1)1,
12(4)469,
12(5)575,
12(6)705,
12(8)959,
12(10)1187,
12(10)1232,
13(5)622,
13(6)749,
13(6)768,
13(7)842,
13(7)883,
13(8)979,
14(2)161,
14(3)253,
14(3)353,
14(4)484,
14(5)503,
14(5)530,
14(7)799,
14(7)858,
14(8)922,
14(8)928,
14(9)1036,
14(9)1101,
15(1)12,
15(1)28,
15(2)200,
15(10)1064,
15(11)1187,
16(3)370,
16(5)628,
16(6)777,
16(7)791,
16(7)898,
16(8)1027,
16(9)1081,
16(12)1483,
17(1)87,
17(3)350,
17(3)358,
17(3)367,
17(5)520,
17(7)790,
17(7)864,
17(8)976,
17(8)1033,
17(10)1229,
17(10)1258,
17(11)1296,
17(14)1587,
18(2)268,
18(3)301,
18(3)313,
18(4)569,
18(5)660,
18(5)677,
18(6)744,
18(7)955,
18(8)980,
18(13)1682,
18(14)1729,
18(15)1848,
19(4)377,
19(7)754,
19(13)1456,
20(3)322,
20(5)483,
20(5)499,
20(6)579,
20(14)1495,
20(14)1533,
20(16)1731
- field,
11(3)351,
11(5)548,
11(5)560,
11(5)623,
11(5)654,
11(7)819,
11(7)848,
11(10)1125,
12(1)78,
12(2)186,
12(3)385,
12(6)731,
12(7)844,
12(8)934,
12(10)1232,
13(2)229,
13(3)257,
13(6)675,
13(7)830,
13(7)888,
13(10)1234,
14(1)45,
14(2)237,
14(2)246,
14(3)263,
14(3)353,
14(6)680,
14(8)928,
14(9)1066,
14(11)1281,
15(1)90,
15(2)162,
15(3)251,
15(3)269,
15(4)405,
15(4)455,
15(7)684,
15(7)752,
15(9)1019,
15(11)1254,
16(1)37,
16(1)56,
16(2)188,
16(3)378,
16(4)449,
16(5)595,
16(5)610,
16(7)856,
16(7)883,
16(8)937,
16(8)973,
16(10)1291,
16(11)1445,
17(1)124,
17(4)450,
17(5)490,
17(5)520,
17(5)553,
17(5)587,
17(5)616,
17(5)642,
17(8)1068,
17(11)1296,
17(12)1406,
17(13)1541,
17(14)1645,
18(2)211,
18(2)221,
18(3)351,
18(4)449,
18(4)533,
18(7)849,
18(7)874,
18(8)1043,
18(11)1371,
18(13)1664,
18(16)1955,
18(16)2093,
19(2)250,
19(3)259,
19(4)430,
19(5)535,
19(7)754,
19(7)769,
19(9)1001,
19(13)1515,
19(16)1887,
19(16)1899,
20(4)455,
20(5)531,
20(7)704,
20(7)730,
20(8)799,
20(10)1009,
20(14)1495
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11(3)351,
11(3)401,
11(5)560,
11(5)623,
11(5)654,
11(7)819,
11(7)848,
11(10)1125,
12(1)78,
12(1)91,
12(2)186,
12(3)385,
12(4)469,
12(5)575,
12(6)664,
12(6)731,
12(6)761,
12(7)844,
12(8)934,
12(10)1232,
13(3)257,
13(5)585,
13(7)888,
13(9)1098,
13(9)1142,
14(1)45,
14(3)263,
14(3)353,
14(6)728,
14(6)751,
14(9)1066,
14(11)1281,
15(2)162,
15(3)251,
15(4)405,
15(4)455,
15(7)667,
15(7)684,
15(7)752,
15(9)1019,
15(11)1254,
15(11)1291,
16(1)56,
16(2)188,
16(5)527,
16(5)595,
16(5)610,
16(7)883,
16(8)923,
16(8)937,
16(8)973,
16(9)1120,
16(9)1131,
17(4)450,
17(5)490,
17(5)520,
17(5)553,
17(5)587,
17(5)616,
17(5)642,
17(8)1068,
17(9)1112,
17(12)1406,
17(13)1541,
18(2)211,
18(2)221,
18(3)351,
18(4)449,
18(4)533,
18(7)849,
18(7)874,
18(8)1043,
18(11)1371,
18(13)1656,
18(13)1664,
18(14)1750,
18(16)1955,
18(16)2050,
18(16)2093,
19(3)259,
19(4)430,
19(5)535,
19(7)754,
19(7)769,
19(9)1001,
19(10)1187,
19(13)1515,
20(4)455,
20(5)531,
20(7)704,
20(7)730,
20(8)799,
20(10)1009,
20(11)1165,
20(11)1177
- including,
12(5)611,
13(9)1089,
14(5)510,
18(12)1440
- mechanics,
11(3)326,
11(4)440,
11(7)848,
11(7)868,
11(8)952,
11(9)1061,
11(9)1087,
12(1)78,
12(2)200,
12(3)310,
12(3)385,
12(4)427,
12(5)575,
12(5)620,
12(7)839,
12(7)872,
12(7)880,
12(8)943,
12(8)994,
12(10)1232,
13(1)57,
13(4)408,
13(4)525,
13(5)541,
13(5)633,
13(7)851,
13(8)971,
13(9)1125,
13(9)1138,
13(9)1142,
14(3)353,
14(4)379,
14(4)455,
14(6)655,
14(7)755,
14(8)881,
14(8)977,
15(2)190,
15(3)283,
15(3)333,
15(8)866,
15(10)1105,
15(11)1228,
15(11)1254,
15(12)1321,
15(12)1446,
16(1)1,
16(5)620,
16(7)856,
16(9)1131,
16(9)1170,
16(10)1250,
17(1)19,
17(2)156,
17(4)396,
17(4)429,
17(5)669,
17(5)695,
17(5)730,
17(5)747,
17(8)1013,
17(9)1132,
17(11)1328,
17(12)1395,
17(12)1481,
17(13)1564,
18(2)221,
18(2)254,
18(4)449,
18(5)712,
18(8)1056,
18(9)1211,
18(11)1371,
18(12)1496,
18(12)1523,
18(13)1632,
18(14)1804,
18(15)1827,
19(1)71,
19(5)512,
19(7)754,
19(10)1146,
19(10)1167,
19(12)1370,
19(12)1387,
19(12)1402,
20(6)604,
20(10)1028,
20(10)1067,
20(13)1379,
20(13)1401,
20(15)1618
- model,
0(0)xvii--493,
11(2)266,
11(5)560,
11(8)899,
11(8)924,
11(8)994,
12(1)52,
12(5)635,
12(7)784,
12(7)792,
12(7)899,
12(10)1187,
13(2)115,
13(2)199,
13(6)704,
13(7)793,
13(7)810,
13(7)883,
13(8)952,
13(9)1089,
13(9)1109,
14(1)19,
14(1)89,
14(3)253,
14(3)263,
14(5)503,
14(6)667,
14(6)680,
14(7)775,
14(8)970,
14(10)1149,
14(10)1250,
14(12)1423,
14(12)1534,
15(7)719,
15(10)1064,
16(1)1,
16(1)20,
16(2)188,
16(2)243,
16(3)385,
16(4)422,
16(4)486,
16(4)501,
16(5)628,
16(6)705,
16(6)777,
16(8)1027,
16(9)1081,
16(9)1164,
16(10)1181,
16(12)1468,
16(12)1543,
17(2)148,
17(2)204,
17(7)757,
17(7)821,
17(7)841,
17(8)1056,
17(9)1099,
17(10)1229,
17(14)1633,
17(15)1757,
18(1)108,
18(2)198,
18(4)562,
18(8)1061,
18(12)1496,
18(13)1632,
18(13)1647,
18(13)1668,
18(16)2075,
19(3)290,
19(4)396,
19(4)404,
19(7)754,
19(7)769,
19(8)833,
19(8)847,
19(8)977,
19(15)1675,
20(3)322,
20(3)354,
20(6)579,
20(9)897,
20(9)928,
20(9)956,
20(11)1145,
20(11)1186,
20(12)1292,
20(12)1299,
20(13)1379,
20(14)1533,
20(16)1693,
20(16)1702
- polarization,
11(3)311,
16(1)20,
19(8)833,
19(8)866,
20(7)704,
20(9)937,
20(9)971