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Natural steric analysis: Ab initio van der Waals radii of atoms and ions

✍ Scribed by Badenhoop, J. K.; Weinhold, F.


Book ID
118227529
Publisher
American Institute of Physics
Year
1997
Tongue
English
Weight
401 KB
Volume
107
Category
Article
ISSN
0021-9606

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Calibration of effective van der Waals a
✍ Hiroshi Iijima; James B. Dunbar Jr.; Dr. Garland R. Marshall πŸ“‚ Article πŸ“… 1987 πŸ› John Wiley and Sons 🌐 English βš– 897 KB

Effective van der Waals radii were calibrated in such a way that molecular models built from standard bond lengths and bond angles reproduced the amino acid conformations observed by crystallography in proteins and peptides. The calibrations were based on the comparison of the Ramachandran plots pre