Robustness in the Fitting of Molecular Mechanics Parameters.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 8, p. 1083, doi. 10.1002/jcc.23897
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 2015 AND VI 36 AND IP 8
Results: 7
1
2
Revisiting the Extrapolation of Correlation Energies to Complete Basis Set Limit.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 8, p. 1075, doi. 10.1002/jcc.23896
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- Publication type:
- Article
3
Protein Alignment: Exact Versus Approximate. An Illustration.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 8, p. 1069, doi. 10.1002/jcc.23892
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- Publication type:
- Article
4
Gradient Gravitational Search: An Efficient Metaheuristic Algorithm for Global Optimization.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 8, p. 1060, doi. 10.1002/jcc.23891
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- Publication type:
- Article
5
LS-VISM: A Software Package for Analysis of Biomolecular Solvation.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 8, p. 1047, doi. 10.1002/jcc.23890
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- Publication type:
- Article
6
A Cascaded QSAR Model for Efficient Prediction of Overall Power Conversion Efficiency of All-Organic Dye-Sensitized Solar Cells.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 8, p. 1036, doi. 10.1002/jcc.23886
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- Publication type:
- Article
7
Are the Reduction and Oxidation Properties of Nitrocompounds Dissolved in Water Different From Those Produced When Adsorbed on a Silica Surface? A DFT M05-2X Computational Study.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 8, p. 1029, doi. 10.1002/jcc.23878
- By:
- Publication type:
- Article