Biophysical tools for structure-based drug design
β Scribed by John J. Wendoloski; Jian Shen; Maureen Toner Oliva; Patricia C. Weber
- Book ID
- 113246898
- Publisher
- Elsevier Science
- Year
- 1993
- Tongue
- English
- Weight
- 852 KB
- Volume
- 60
- Category
- Article
- ISSN
- 0163-7258
No coin nor oath required. For personal study only.
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## Abstract The computer program LUDI for automated structureβbased drug design is described. The program constructs possible new ligands for a given protein of known threeβdimensional structure. This novel approach is based upon rules about energetically favourable nonβbonded contact geometries be