-
1
-
-
0040373295
-
Molecular Similarity I
-
K.D. Sen Springer Berlin
-
D.H. Rouvray K.D. Sen Molecular Similarity I Topics in Current Chemistry vol. 173 1995 Springer Berlin 2
-
(1995)
Topics in Current Chemistry
, vol.173
, pp. 2
-
-
Rouvray, D.H.1
-
11
-
-
0035960239
-
-
G. Boon, W. Langenaeker, F. De Proft, H. De Winter, J.P. Tollenaere, and P. Geerlings J. Phys. Chem. A. 105 2001 8805
-
(2001)
J. Phys. Chem. A.
, vol.105
, pp. 8805
-
-
Boon, G.1
Langenaeker, W.2
De Proft, F.3
De Winter, H.4
Tollenaere, J.P.5
Geerlings, P.6
-
12
-
-
0346937294
-
-
G. Boon, C. Van Alsenoy, F. De Proft, P. Bultinck, and P. Geerlings J. Phys. Chem. A 107 2003 11120
-
(2003)
J. Phys. Chem. a
, vol.107
, pp. 11120
-
-
Boon, G.1
Van Alsenoy, C.2
De Proft, F.3
Bultinck, P.4
Geerlings, P.5
-
19
-
-
2942665493
-
-
P.J. Stephens, D.M. McCann, F.J. Devlin, J.R. Cheeseman, and M.J. Frisch J. Am. Chem. Soc. 126 2004 7514
-
(2004)
J. Am. Chem. Soc.
, vol.126
, pp. 7514
-
-
Stephens, P.J.1
McCann, D.M.2
Devlin, F.J.3
Cheeseman, J.R.4
Frisch, M.J.5
-
25
-
-
23644448137
-
-
in press.
-
R. Ponec, P. Bultinck, S. Vandamme, R. Carbó-Dorca, D.J. Tantillo, Theor. Chem. Acc. (2005) in press.
-
(2005)
Theor. Chem. Acc.
-
-
Ponec, R.1
Bultinck, P.2
Vandamme, S.3
Carbó-Dorca, R.4
Tantillo, D.J.5
-
28
-
-
23644448636
-
-
Ghent University, Graduation Thesis, Ghent Quantum Chemistry Group
-
S. Van Damme, Ghent University, Graduation Thesis, Ghent Quantum Chemistry Group, 2004.
-
(2004)
-
-
Van Damme, S.1
-
36
-
-
0141704726
-
-
Gaussian, Inc., Pittsburgh PA
-
M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery, Jr., T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez, J.A. Pople, gaussian03, Revision B.03, Gaussian, Inc., Pittsburgh PA, 2003.
-
(2003)
gaussian03, Revision B.03
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Montgomery Jr., J.A.7
Vreven, T.8
Kudin, K.N.9
Burant, J.C.10
Millam, J.M.11
Iyengar, S.S.12
Tomasi, J.13
Barone, V.14
Mennucci, B.15
Cossi, M.16
Scalmani, G.17
Rega, N.18
Petersson, G.A.19
Nakatsuji, H.20
Hada, M.21
Ehara, M.22
Toyota, K.23
Fukuda, R.24
Hasegawa, J.25
Ishida, M.26
Nakajima, T.27
Honda, Y.28
Kitao, O.29
Nakai, H.30
Klene, M.31
Li, X.32
Knox, J.E.33
Hratchian, H.P.34
Cross, J.B.35
Adamo, C.36
Jaramillo, J.37
Gomperts, R.38
Stratmann, R.E.39
Yazyev, O.40
Austin, A.J.41
Cammi, R.42
Pomelli, C.43
Ochterski, J.W.44
Ayala, P.Y.45
Morokuma, K.46
Voth, G.A.47
Salvador, P.48
Dannenberg, J.J.49
Zakrzewski, V.G.50
Dapprich, S.51
Daniels, A.D.52
Strain, M.C.53
Farkas, O.54
Malick, D.K.55
Rabuck, A.D.56
Raghavachari, K.57
Foresman, J.B.58
Ortiz, J.V.59
Cui, Q.60
Baboul, A.G.61
Clifford, S.62
Cioslowski, J.63
Stefanov, B.B.64
Liu, G.65
Liashenko, A.66
Piskorz, P.67
Komaromi, I.68
Martin, R.L.69
Fox, D.J.70
Keith, T.71
Al-Laham, M.A.72
Peng, C.Y.73
Nanayakkara, A.74
Challacombe, M.75
Gill, P.M.W.76
Johnson, B.77
Chen, W.78
Wong, M.W.79
Gonzalez, C.80
Pople, J.A.81
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