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Molecular Informatics

Volumn 30, Issue 6-7, 2011, Pages 593-603

Interpretation of QSAR models based on random forest methods

(4) Kuz'min, Victor E a Polishchuk, Pavel G a Artemenko, Anatoly G a Andronati, Sergey A a

a A V BOGATSKY PHYSICO CHEMICAL INSTITUTE (Ukraine)

Author keywords

Random Forest interpretation; Simplex representation of molecular structure

Indexed keywords

COMPUTATIONAL CHEMISTRY; MOLECULAR GRAPHICS;

DESCRIPTORS; MODEL-BASED OPC; PROPERTY VALUE; QSAR MODEL; RANDOM FOREST INTERPRETATION; RANDOM FOREST METHODS; RANDOM FOREST MODELING; RANDOM FORESTS; SIMPLEX REPRESENTATION; SIMPLEX REPRESENTATION OF MOLECULAR STRUCTURE;

MOLECULAR STRUCTURE;

SEROTONIN 1A RECEPTOR;

ARTICLE; CHEMICAL STRUCTURE; LATENT STRUCTURE ANALYSIS; PRIORITY JOURNAL; PROTEIN STRUCTURE; RANDOM FOREST; STRUCTURE ACTIVITY RELATION;

EID: 79960570801 PISSN: 18681743 EISSN: 18681751 Source Type: Journal
DOI: 10.1002/minf.201000173 Document Type: Article

Times cited : (68)

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