Comparison of van der Waals and semiempi
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Lorraine M. Rellick; Wayne J. Becktel
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Article
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1997
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Wiley (John Wiley & Sons)
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English
โ 197 KB
๐ 2 views
Molecular volumes for hydrocarbons, amino acids, peptides, and 14 globular proteins were calculated by techniques using van der Waals radii and by semiempirical molecular orbital methods. The resulting values were compared to experimentally determined volumes. The values obtained by methods employin