A rapid python-based methodology for target-focused combinatorial library design

Combinatorial Chemistry and High Throughput Screening

Volumn 19, Issue 1, 2016, Pages 25-35

  Li, Shiliang ^a   Song, Yuwei ^a   Liu, Xiaofeng ^a   Li, Honglin ^a  

^a EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

Author keywords

3D molecular similarity; Chemical space; Focused library design; Product based; Reaction based; Smiles

Indexed keywords

CYCLOOXYGENASE 2; CYCLOOXYGENASE 2 INHIBITOR; MOLECULAR LIBRARY;

ARTICLE; CALCULATION; CHEMICAL REACTION; COMBINATORIAL LIBRARY; COMPUTER PROGRAM; METHODOLOGY; MOLECULE; PRIORITY JOURNAL; CHEMISTRY; COMBINATORIAL CHEMISTRY; DRUG DELIVERY SYSTEM; DRUG DEVELOPMENT; MOLECULAR LIBRARY; PROCEDURES; TIME FACTOR;

COMBINATORIAL CHEMISTRY TECHNIQUES; CYCLOOXYGENASE 2 INHIBITORS; DRUG DELIVERY SYSTEMS; DRUG DISCOVERY; SMALL MOLECULE LIBRARIES; TIME FACTORS;

EID: 84959341665     PISSN: 13862073     EISSN: 18755402     Source Type: Journal    
DOI: 10.2174/1386207318666151102094055     Document Type: Article

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