NNScore 2.0: A neural-network receptor-ligand scoring function

Journal of Chemical Information and Modeling

Volumn 51, Issue 11, 2011, Pages 2897-2903

  Durrant, Jacob D ^a   McCammon, J Andrew ^a,b  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

APPLICATION PROGRAMS; LIGANDS; SOFTWARE TESTING;

APPLICATION EXAMPLES; BINARY CLASSIFICATION; BINDING CHARACTERISTICS; COMPUTATIONAL IDENTIFICATION; ORDERS OF MAGNITUDE; RECEPTOR LIGANDS; SCORING FUNCTIONS; STATE OF THE ART;

NEURAL NETWORKS;

LIGAND; PROTEIN;

ALGORITHM; ARTICLE; ARTIFICIAL NEURAL NETWORK; BINDING SITE; BIOLOGY; CHEMICAL PHENOMENA; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER PROGRAM; HUMAN; METABOLISM; METHODOLOGY; PROTEIN BINDING; PROTEIN DATABASE; RECEIVER OPERATING CHARACTERISTIC; STATIC ELECTRICITY; THERMODYNAMICS;

ALGORITHMS; BINDING SITES; COMPUTATIONAL BIOLOGY; DATABASES, PROTEIN; HUMANS; HYDROPHOBIC AND HYDROPHILIC INTERACTIONS; LIGANDS; MODELS, MOLECULAR; NEURAL NETWORKS (COMPUTER); PROTEIN BINDING; PROTEINS; RESEARCH DESIGN; ROC CURVE; SOFTWARE; STATIC ELECTRICITY; THERMODYNAMICS;

EID: 82355186299     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci2003889     Document Type: Article

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