-
13
-
-
0001481729
-
-
Bader, R. F. W.; Henneker, W. H.; Cade, P. E. J Chem Phys 1967, 46, 3341.
-
(1967)
J Chem Phys
, vol.46
, pp. 3341
-
-
Bader, R.F.W.1
Henneker, W.H.2
Cade, P.E.3
-
15
-
-
0000875606
-
-
Lipkowitz, K. B.; Boyd, D. B., Eds.; VCH: New York
-
Mezey, P. G. In Reviews in Computational Chemistry; Lipkowitz, K. B.; Boyd, D. B., Eds.; VCH: New York, 1990. p. 265.
-
(1990)
Reviews in Computational Chemistry
, pp. 265
-
-
Mezey, P.G.1
-
30
-
-
0027060691
-
-
Gibbs, G. V.; Spackman, M. A.; Boisen, M. B. Am Mineral 1992, 77, 741.
-
(1992)
Am Mineral
, vol.77
, pp. 741
-
-
Gibbs, G.V.1
Spackman, M.A.2
Boisen, M.B.3
-
32
-
-
0002635275
-
-
Trefry, M. G.; Maslen, E. N.; Spackman, M. A. J Phys C: Solid State Phys 1987, 20, 19.
-
(1987)
J Phys C: Solid State Phys
, vol.20
, pp. 19
-
-
Trefry, M.G.1
Maslen, E.N.2
Spackman, M.A.3
-
34
-
-
0042633505
-
-
Maksic, Z. B.; Eckert-Maksic, M.; Rupnik, K. Croat Chem Acta 1984, 57, 1295.
-
(1984)
Croat Chem Acta
, vol.57
, pp. 1295
-
-
Maksic, Z.B.1
Eckert-Maksic, M.2
Rupnik, K.3
-
36
-
-
1242305984
-
-
Maruani, J., Ed.; Kluwer: Amsterdam
-
Maksic, Z. B. In Molecules in Physics, Chemistry, and Biology; Maruani, J., Ed.; Kluwer: Amsterdam, 1989, p. 49.
-
(1989)
Molecules in Physics, Chemistry, and Biology
, pp. 49
-
-
Maksic, Z.B.1
-
38
-
-
0031798154
-
-
McKinnon, J. J.; Mitchell, A. S.; Spackman, M. A. Chem Eur J 1998, 4, 2136.
-
(1998)
Chem Eur J
, vol.4
, pp. 2136
-
-
McKinnon, J.J.1
Mitchell, A.S.2
Spackman, M.A.3
-
40
-
-
84889232624
-
-
Wavefunction Inc.: Irvine, CA
-
Spartan, version 4.0, Wavefunction Inc.: Irvine, CA.
-
Spartan, Version 4.0
-
-
-
41
-
-
0347170005
-
-
Hehre, W. J.; Ditchfield, R.; Pople, J. A. J Chem Phys 1972, 56, 2257.
-
(1972)
J Chem Phys
, vol.56
, pp. 2257
-
-
Hehre, W.J.1
Ditchfield, R.2
Pople, J.A.3
-
43
-
-
84870649266
-
-
Research Collaboratory for Structural Bioinformatics
-
Protein Data Bank, Research Collaboratory for Structural Bioinformatics (http://www.rcsb.org/pdb/).
-
Protein Data Bank
-
-
-
44
-
-
85037505088
-
-
Molecular Simulations Inc.
-
WebLab ViewerLite, Molecular Simulations Inc. (http:// www.msi.com).
-
WebLab ViewerLite
-
-
-
46
-
-
19944425329
-
-
Stewart, R. F.; Davidson, E. R.; Simpson, W. T. J Chem Phys 1965, 42, 3175.
-
(1965)
J Chem Phys
, vol.42
, pp. 3175
-
-
Stewart, R.F.1
Davidson, E.R.2
Simpson, W.T.3
-
47
-
-
11744283687
-
-
Hehre, W. J.; Stewart, R. F.; Pople, J. A. J Chem Phys 1969, 51, 2657.
-
(1969)
J Chem Phys
, vol.51
, pp. 2657
-
-
Hehre, W.J.1
Stewart, R.F.2
Pople, J.A.3
-
49
-
-
84913537730
-
-
Heiden, W.; Goetze, T.; Brickmann, J. J Comp Chem 1993, 14, 246.
-
(1993)
J Comp Chem
, vol.14
, pp. 246
-
-
Heiden, W.1
Goetze, T.2
Brickmann, J.3
-
50
-
-
84986533533
-
-
Silla, E.; Tunon, I.; Pascual-Ahuir, J. L. J Comp Chem 1991, 12, 1077.
-
(1991)
J Comp Chem
, vol.12
, pp. 1077
-
-
Silla, E.1
Tunon, I.2
Pascual-Ahuir, J.L.3
-
52
-
-
84986533814
-
-
Wong, M.; Wiberg, K.; Frisch, M. J Comp Chem 1995, 16, 385.
-
(1995)
J Comp Chem
, vol.16
, pp. 385
-
-
Wong, M.1
Wiberg, K.2
Frisch, M.3
-
53
-
-
0003474751
-
-
Cambridge University Press: Cambridge, UK
-
Press, W. H.; Flannery, B. P.; Teukolsky, S. A.; Vetterling, W. T. Numerical Recipes: The Art of Scientific Computing; Cambridge University Press: Cambridge, UK, 1986.
-
(1986)
Numerical Recipes: The Art of Scientific Computing
-
-
Press, W.H.1
Flannery, B.P.2
Teukolsky, S.A.3
Vetterling, W.T.4
-
54
-
-
33845281510
-
-
Bader, R. F. W.; Carroll, M. T.; Cheeseman, J. R.; Chang, C. J Am Chem Soc 1987, 109, 7968.
-
(1987)
J Am Chem Soc
, vol.109
, pp. 7968
-
-
Bader, R.F.W.1
Carroll, M.T.2
Cheeseman, J.R.3
Chang, C.4
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