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DOCKER, an interactive program for simulating protein receptor and substrate interactions

✍ Scribed by Busetta, B. ;Tickle, I. J. ;Blundell, T. L.


Book ID
114499566
Publisher
International Union of Crystallography
Year
1983
Tongue
English
Weight
753 KB
Volume
16
Category
Article
ISSN
0021-8898

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YETI, an interactive molecular mechanics program for drug-design applications on small-molecule protein complexes, is described. To model short-range interactions in better agreement with experimental data, its force-field energy expression includes directional potential functions for H-bonds, salt