Works matching IS 01928651 AND DT 1995 AND VI 16 AND IP 12
Results: 11
Harmonic analysis of large systems. II. Comparison of different protein models.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1543, doi. 10.1002/jcc.540161210
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Localization and quantitative evaluation of potent local binding sites on the accessible Lennard-jones surface.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1459, doi. 10.1002/jcc.540161203
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Harmonic analysis of large systems. I. Methodology.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1522, doi. 10.1002/jcc.540161209
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Remarks on the use of the apparent surface charges (ASC) methods in solvation problems: Iterative versus matrix-inversion procedures and the renormalization of the apparent charges.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1449, doi. 10.1002/jcc.540161202
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Calculation of molecular geometries, relative conformational energies, dipole moments, and molecular electrostatic potential fitted charges of small organic molecules of biochemical interest by density functional theory.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1483, doi. 10.1002/jcc.540161206
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Masthead.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. fmi, doi. 10.1002/jcc.540161201
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- Article
Application of the shape group method to conformational processes: Shape and conjugation changes in the conformers of 2-phenyl pyrimidine.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1474, doi. 10.1002/jcc.540161205
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Numerical evaluation of three- and four-center bielectronic integrals using exponential-type atomic orbitals.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1507, doi. 10.1002/jcc.540161207
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Harmonic analysis of large systems. III. Comparison with molecular dynamics.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1554, doi. 10.1002/jcc.540161211
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Incorporating the protein - dipole Langevin - dipole model into Tanford-Kirkwood theory.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1468, doi. 10.1002/jcc.540161204
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Calculation of relative free energy differences for the covalent hydration of organic compounds: A combined quantum mechanical and free energy perturbation study.
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- Journal of Computational Chemistry, 1995, v. 16, n. 12, p. 1513, doi. 10.1002/jcc.540161208
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- Article