Comparative molecular field analysis and molecular modeling studies of 20-(S)-camptothecin analogs as inhibitors of DNA topoisomerase I and anticancer/antitumor agents

Journal of Computer-Aided Molecular Design

Volumn 11, Issue 1, 1997, Pages 71-78

  Carrigan, Sean W ^a   Fox, Peter C ^a   Wall, Monroe E ^b   Wani, Mansukh C ^b   Bowen, J Phillip ^a  

^a UNIVERSITY OF GEORGIA   (United States)

^b RTI INTERNATIONAL   (United States)

Author keywords

Camptothecin; CoMFA; MM3

Indexed keywords

BODY FLUIDS; COMPUTATIONAL CHEMISTRY; LEAST SQUARES APPROXIMATIONS;

ANALYSIS MODELS; ANTITUMOUR AGENTS; CAMPTOTHECIN ANALOGS; CAMPTOTHECINS; COMPARATIVE MOLECULAR FIELD ANALYSIS; DATA SET; DNA TOPOISOMERASE I; MM3; MOLECULAR MODELING STUDIES; TOPOISOMERASE I;

ISOMERS;

ANTINEOPLASTIC AGENT; CAMPTOTHECIN; DNA TOPOISOMERASE; DRUG DERIVATIVE; ENZYME INHIBITOR;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPARATIVE STUDY; COMPUTER SIMULATION; CONFORMATION; DRUG ANTAGONISM; FACTUAL DATABASE; HUMAN; STRUCTURE ACTIVITY RELATION; THERMODYNAMICS;

ANTINEOPLASTIC AGENTS; CAMPTOTHECIN; COMPUTER SIMULATION; DATABASES, FACTUAL; DNA TOPOISOMERASES, TYPE I; ENZYME INHIBITORS; HUMANS; MODELS, MOLECULAR; MOLECULAR CONFORMATION; STRUCTURE-ACTIVITY RELATIONSHIP; THERMODYNAMICS;

EID: 0030636777     PISSN: 0920654X     EISSN: None     Source Type: Journal    
DOI: 10.1023/A:1008027528218     Document Type: Article

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