ISSN:
1572-8951
Keywords:
Drug design
;
enzyme catalysis
;
molecular graphics
;
molecular modeling
;
computer simulation methods
Source:
Springer Online Journal Archives 1860-2000
Topics:
Chemistry and Pharmacology
Notes:
Abstract A survey is presented of model building techniques, computer-assisted molecular dynamics simulations and a new theory of enzyme catalysis. Some aspects of the theoretical formalism are given. Enzyme active-site directed drug design is illustrated with examples taken from molecular modeling studies using FAD-containing disulphide oxidoreductases, proteinases and carbonic anhydrases.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF01003761
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