Parallel direct implementations of second-order perturbation theories.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1301, doi. 10.1002/jcc.540161011
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 1995 AND VI 16 AND IP 10
Results: 11
1
2
Discrete, dynamic polymer modeling: A pseudo-diatomic model of lignin.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1181, doi. 10.1002/jcc.540161002
- By:
- Publication type:
- Article
3
Toward similarity measures for macromolecular bodies: Medla test calculations for substituted benzene systems.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1238, doi. 10.1002/jcc.540161006
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- Publication type:
- Article
4
Flexible ligand docking without parameter adjustment across four ligand-receptor complexes.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1210, doi. 10.1002/jcc.540161004
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- Publication type:
- Article
5
A comparative quantum mechanical study of bond separation energies as a measure of cyclic conjugation.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1227, doi. 10.1002/jcc.540161005
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- Publication type:
- Article
6
Masthead.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. fmi, doi. 10.1002/jcc.540161001
- Publication type:
- Article
7
Reduced variable molecular dynamics.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1271, doi. 10.1002/jcc.540161009
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- Publication type:
- Article
8
Ab initio and molecular mechanics (MM2 and MM3) calculations of nonconjugated positively charged nitrogen-containing compounds.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1250, doi. 10.1002/jcc.540161007
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- Publication type:
- Article
9
Ab initio calculations of the ultraviolet resonance Raman spectra of uracil.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1261, doi. 10.1002/jcc.540161008
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- Publication type:
- Article
10
Algorithms for constrained molecular dynamics.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1192, doi. 10.1002/jcc.540161003
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- Publication type:
- Article
11
Approaches to large-scale parallel self-consistent field calculations.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 10, p. 1291, doi. 10.1002/jcc.540161010
- By:
- Publication type:
- Article