Solvation in octanol: parametrization of the continuum MST model.
- Published in:
- Journal of Computational Chemistry, 2001, v. 22, n. 11, p. 1180, doi. 10.1002/jcc.1076
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 2001 AND VI 22 AND IP 11
Results: 7
1
2
An improved GROMOS96 force field for aliphatic hydrocarbons in the condensed phase.
- Published in:
- Journal of Computational Chemistry, 2001, v. 22, n. 11, p. 1205, doi. 10.1002/jcc.1078
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- Publication type:
- Article
3
OH hydrogen abstraction reactions from alanine and glycine: A quantum mechanical approach.
- Published in:
- Journal of Computational Chemistry, 2001, v. 22, n. 11, p. 1138, doi. 10.1002/jcc.1073
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- Publication type:
- Article
4
When anomeric effects collide.
- Published in:
- Journal of Computational Chemistry, 2001, v. 22, n. 11, p. 1194, doi. 10.1002/jcc.1077
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- Publication type:
- Article
5
Solvated ensemble averaging in the calculation of partial atomic charges.
- Published in:
- Journal of Computational Chemistry, 2001, v. 22, n. 11, p. 1125, doi. 10.1002/jcc.1072
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- Publication type:
- Article
6
Improved intermolecular force field for molecules containing H, C, N, and O atoms, with application to nucleoside and peptide crystals.
- Published in:
- Journal of Computational Chemistry, 2001, v. 22, n. 11, p. 1154, doi. 10.1002/jcc.1074
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- Publication type:
- Article
7
Quantum chemical characterization of the cytosine: 2-Aminopurine base pair.
- Published in:
- Journal of Computational Chemistry, 2001, v. 22, n. 11, p. 1167, doi. 10.1002/jcc.1075
- By:
- Publication type:
- Article