-
45
-
-
0029011701
-
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 5179
-
-
Cornell, W.D.1
Cieplak, P.2
Bayley, C.I.3
Gould, I.R.4
Merz, K.M.5
Ferguson, D.M.6
Spellmeyer, D.C.7
Fox, T.8
Caldwell, J.W.9
Kollman, P.A.10
-
46
-
-
0000253709
-
-
(1996)
QCPE
, vol.16
, pp. 671
-
-
Hase, W.L.1
Duchovic, R.J.2
Hu, X.3
Komornicki, A.4
Lim, K.F.5
Lu, D.-H.6
Peslherbe, G.H.7
Swamy, K.N.8
Vande Linde, S.R.9
Zhu, L.10
Varandas, A.11
Wang, H.12
Wolf, R.J.13
-
54
-
-
0004133516
-
-
Gaussian Inc.: Pittsburgh, PA
-
(1998)
Gaussian 98 and Revision A.7
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery, J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, V.J.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.51
Chen, G.52
Wong, W.M.53
Andres, W.J.L.54
Head-Gordon, M.55
Replogle, E.S.56
Pople, J.A.57
more..
-
57
-
-
53149087875
-
-
Ferguson, D., Siepmann, J. I., Truhlar, D. G., Eds.; Wiley: New York
-
(1999)
Advances in Chemical Physics
, vol.105
, pp. 171
-
-
Peslherbe, G.H.1
Wang, H.2
Hase, W.L.3
-
69
-
-
0033538311
-
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 5142
-
-
Tsaprailis, G.1
Nair, H.2
Somogyi, A.3
Wysocki, V.H.4
Zhang, W.5
Futrell, J.H.6
Summerfeld, S.G.7
Gaskell, S.J.8
-
70
-
-
2042464424
-
-
See ref 14 and references therein
-
-
-
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