Works matching IS 01928651 AND DT 1995 AND VI 16 AND IP 7
Results: 8
Mono- and poly-ligated complexes of Zn<sup>2+</sup>: An ab initio analysis of the metal-ligand interaction energy.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. 843, doi. 10.1002/jcc.540160704
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- Article
Masthead.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. fmi, doi. 10.1002/jcc.540160701
- Publication type:
- Article
Energetics of Zn<sup>2+</sup> binding to a series of biologically relevant ligands: A molecular mechanics investigation grounded on ab initio self-consistent field supermolecular computations.
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- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. 856, doi. 10.1002/jcc.540160705
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- Article
An improved molecular modeling method for the prediction of enantioselectivity.
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- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. 914, doi. 10.1002/jcc.540160708
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- Article
An improved algorithm for the analytical computation of solvent-excluded volume. The treatment of singularities in solvent-accessible surface area and volume functions.
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- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. 817, doi. 10.1002/jcc.540160703
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- Article
The fast multipole boundary element method for molecular electrostatics: An optimal approach for large systems.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. 898, doi. 10.1002/jcc.540160707
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- Article
Accurate modeling of the intramolecular electrostatic energy of proteins.
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- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. 791, doi. 10.1002/jcc.540160702
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- Article
Force field studies of cholesterol and cholesteryl acetate crystals and cholesterol-cholesterol intermolecular interactions.
- Published in:
- Journal of Computational Chemistry, 1995, v. 16, n. 7, p. 883, doi. 10.1002/jcc.540160706
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- Article