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Structure-based drug design: Workings of a molecular multi-tool

โœ Scribed by Kirkpatrick, Peter


Book ID
109949284
Publisher
Nature Publishing Group
Year
2003
Tongue
English
Weight
97 KB
Volume
2
Category
Article
ISSN
1474-1776

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โœ Hans-Joachim Bรถhm ๐Ÿ“‚ Article ๐Ÿ“… 1993 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 776 KB

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