Rapid evaluation of molecular shape similarity index using pairwise calculation of the nearest atomic distances

Journal of Chemical Information and Computer Sciences

Volumn 42, Issue 1, 2002, Pages 58-63

  Kotani, Takayuki ^a   Higashiura, Kunihiko ^a  

^a Nippon Zoki Pharmaceutical Co   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC DISTANCES; MOLECULAR SHAPES;

ATOMS; DRUG PRODUCTS; MATHEMATICAL MODELS; VAN DER WAALS FORCES;

MOLECULAR DYNAMICS;

EID: 0036429879     PISSN: 00952338     EISSN: None     Source Type: Journal    
DOI: 10.1021/ci010068d     Document Type: Article

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