Continuous similarity measure between nonoverlapping X-ray powder diagrams of different crystal modifications.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1125, doi. 10.1002/jcc.540141002
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 1993 AND VI 14 AND IP 10
Results: 14
1
2
Accuracy of free energies of hydration for organic molecules from 6-31g*-derived partial charges.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1240, doi. 10.1002/jcc.540141013
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- Publication type:
- Article
3
Divide-and-conquer, pattern matching, and relaxation methods in interpretation of 2-D NMR spectra of polypeptides.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1164, doi. 10.1002/jcc.540141006
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- Publication type:
- Article
4
Masthead.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. fmi, doi. 10.1002/jcc.540141001
- Publication type:
- Article
5
Ab initio SCF and Møller-plesset studies on hexafluorides of selenium and tellurium.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1234, doi. 10.1002/jcc.540141012
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- Publication type:
- Article
6
Ab initio models for multiple-hydrogen exchange: Comparison of cyclic four- and six-center systems.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1149, doi. 10.1002/jcc.540141005
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- Publication type:
- Article
7
Lattice representations of globular proteins: How good are they?
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1194, doi. 10.1002/jcc.540141009
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- Publication type:
- Article
8
LIN: A new algorithm to simulate the dynamics of biomolecules by combining implicit-integration and normal mode techniques.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1212, doi. 10.1002/jcc.540141011
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- Publication type:
- Article
9
Parallel direct SCF and gradient program for workstation clusters.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1142, doi. 10.1002/jcc.540141004
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- Publication type:
- Article
10
CONCEPTS: New dynamic algorithm for de novo drug suggestion.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1184, doi. 10.1002/jcc.540141008
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- Publication type:
- Article
11
Long-Range multicenter integrals with slater functions: Gauss transform-based methods.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1203, doi. 10.1002/jcc.540141010
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- Publication type:
- Article
12
Calculation of the interaction energy in a localized representation for a trimer (Ne<sub>3</sub>) system.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1136, doi. 10.1002/jcc.540141003
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- Publication type:
- Article
13
MNDO-PM3 study on model cytochrome P450-mediated desulfuration of thiophosphoryl trifluoride, trimethylphosphine sulfide, and trimethyl phosphorothionate.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1250, doi. 10.1002/jcc.540141014
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- Publication type:
- Article
14
Shape groups of the electronic isodensity surfaces for small molecules: Shapes of 10-electron hydrides.
- Published in:
- Journal of Computational Chemistry, 1993, v. 14, n. 10, p. 1172, doi. 10.1002/jcc.540141007
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- Publication type:
- Article