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LigBuilder: A Multi-Purpose Program for Structure-Based Drug Design

✍ Scribed by Renxiao Wang; Ying Gao; Luhua Lai

Publisher
Springer-Verlag
Year
2000
Tongue
English
Weight
284 KB
Volume
6
Category
Article
ISSN
1610-2940

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## Abstract The computer program LUDI for automated structure‐based drug design is described. The program constructs possible new ligands for a given protein of known three‐dimensional structure. This novel approach is based upon rules about energetically favourable non‐bonded contact geometries be