RASA: A rapid retrosynthesis-based scoring method for the assessment of synthetic accessibility of drug-like molecules

Journal of Chemical Information and Modeling

Volumn 51, Issue 10, 2011, Pages 2768-2777

  Huang, Qi ^a   Li, Lin Li ^a   Yang, Sheng Yong ^a  

^a SICHUAN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

FORESTRY; MOLECULES; REGRESSION ANALYSIS;

COMBINATORIAL EXPLOSION; CORRELATION COEFFICIENT; INDIVIDUAL COMPONENTS; RETROSYNTHETIC ANALYSIS; SCORING FUNCTIONS; SCORING METHODS; SYNTHETIC ROUTES; TARGET MOLECULE;

SYNTHESIS (CHEMICAL);

DRUG;

ARTICLE; CHEMISTRY; COMPUTER INTERFACE; COMPUTER PROGRAM; DRUG DESIGN; ELECTRON TRANSPORT; METHODOLOGY; REPRODUCIBILITY; SYNTHESIS; TIME;

CHEMISTRY TECHNIQUES, SYNTHETIC; DRUG DESIGN; ELECTRON TRANSPORT; PHARMACEUTICAL PREPARATIONS; REPRODUCIBILITY OF RESULTS; SOFTWARE; TIME FACTORS; USER-COMPUTER INTERFACE;

EID: 80054949427     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci100216g     Document Type: Article

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