Consensus Induced Fit Docking (cIFD): methodology, validation, and application to the discovery of novel Crm1 inhibitors.

Journal of computer-aided molecular design

Volumn 26, Issue 11, 2012, Pages 1217-1228

  Kalid, Ori ^a   Toledo Warshaviak, Dora ^b   Shechter, Sharon ^b   Sherman, Woody ^b   Shacham, Sharon ^b  

^a Karyopharm Therapeutics   (United States)

^b NONE

Author keywords

[No Author keywords available]

Indexed keywords

CELL RECEPTOR; CYCLOOXYGENASE 2; DRUG; ESTROGEN RECEPTOR; EXPORTIN 1 PROTEIN; KARYOPHERIN; PTGS2 PROTEIN, HUMAN; RNA DIRECTED DNA POLYMERASE;

ARTICLE; CHEMISTRY; DRUG ANTAGONISM; DRUG DESIGN; DRUG DEVELOPMENT; DRUG SCREENING; FACTUAL DATABASE; HUMAN; MOLECULAR LIBRARY; PROTEIN CONFORMATION; VALIDATION STUDY;

CYCLOOXYGENASE 2; DATABASES, FACTUAL; DRUG DESIGN; DRUG DISCOVERY; DRUG EVALUATION, PRECLINICAL; HIV REVERSE TRANSCRIPTASE; HUMANS; KARYOPHERINS; PHARMACEUTICAL PREPARATIONS; PROTEIN CONFORMATION; RECEPTORS, CYTOPLASMIC AND NUCLEAR; RECEPTORS, ESTROGEN; SMALL MOLECULE LIBRARIES; VALIDATION STUDIES AS TOPIC;

EID: 85027917385     PISSN: None     EISSN: 15734951     Source Type: Journal    
DOI: 10.1007/s10822-012-9611-9     Document Type: Article

References (0)