Predictive flip regression: A technique for QSAR of derivatives of symmetric molecules

Journal of Chemical Information and Modeling

Volumn 45, Issue 5, 2005, Pages 1385-1391

  Clare, Brian W ^a   Supuran, Claudiu T ^b  

^a UNIVERSITY OF WESTERN AUSTRALIA   (Australia)

^b Dipartimento di Chimica   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

DERIVATIVES; FLIP CHIP DEVICES; MOLECULAR DYNAMICS; PARAMETER ESTIMATION; QUANTUM CRYPTOGRAPHY; SET THEORY;

FLIP REGRESSION; ORBITAL ENERGIES; SYMMETRICAL MOLECULES;

REGRESSION ANALYSIS;

CARBONATE DEHYDRATASE INHIBITOR; THROMBIN;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER PROGRAM; COMPUTER SIMULATION; DRUG ANTAGONISM; HUMAN; PROTEIN BINDING; QUANTITATIVE STRUCTURE ACTIVITY RELATION;

CARBONIC ANHYDRASE INHIBITORS; COMPUTER SIMULATION; HUMANS; MOLECULAR STRUCTURE; PROTEIN BINDING; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; SOFTWARE; THROMBIN;

EID: 26944489066     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci050191v     Document Type: Article

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