Works matching IS 01928651 AND DT 1995 AND VI 16 AND IP 6
Results: 13
An analytical algorithm for the rapid determination of the solvent accessibility of points in a three-dimensional lattice around a solute molecule.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 743, doi. 10.1002/jcc.540160610
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Efficient conformational space sampling for nucleosides using internal coordinate Monte Carlo simulations and a modified furanose description.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 667, doi. 10.1002/jcc.540160603
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Dynamic load balancing algorithms for replicated data molecular dynamics.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 715, doi. 10.1002/jcc.540160607
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Theoretical study of the gas-phase addition of HF and HCl to ethylene: Analysis of the catalytic action of dimeric halides.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 659, doi. 10.1002/jcc.540160602
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Comparison of potential-derived charge and atomic multipole models in calculating electrostatic potentials and energies of some nucleic acid bases and pairs.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 777, doi. 10.1002/jcc.540160613
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- Article
The role of the carboxylate ion in models of acyl-chymotrypsin.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 705, doi. 10.1002/jcc.540160606
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Masthead.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. fmi, doi. 10.1002/jcc.540160601
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- Article
The electronic structure of weakly bound systems. II. Ne X<sup>+</sup> and Ar X<sup>+</sup>( X = H<sub>2</sub>O, HCl, and HF) bimolecular cations.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 768, doi. 10.1002/jcc.540160612
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The electronic structure of weakly bound systems. I. Rare-gas bimolecular cations.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 758, doi. 10.1002/jcc.540160611
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A simple yet accurate boundary element method for continuum dielectric calculations.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 681, doi. 10.1002/jcc.540160604
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- Article
The true diatomic potential as a perturbed Morse function.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 723, doi. 10.1002/jcc.540160608
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- Article
Potential energy function for cation-peptide interactions: An ab initio study.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 690, doi. 10.1002/jcc.540160605
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- Article
Genetic algorithms: A robust scheme for geometry optimizations and global minimum structure problems.
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- Journal of Computational Chemistry, 1995, v. 16, n. 6, p. 729, doi. 10.1002/jcc.540160609
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- Article