3D-QSAR studies on antitubercular thymidine monophosphate kinase inhibitors based on different alignment methods

Bioorganic and Medicinal Chemistry Letters

Volumn 16, Issue 4, 2006, Pages 1014-1020

  Aparna, V ^a   Jeevan, J ^a   Ravi, M ^a   Desiraju, G R ^a   Gopalakrishnan, B ^b  

^a UNIVERSITY OF HYDERABAD   (India)

^b TATA CONSULTANCY SERVICES   (India)

Author keywords

3D QSAR; Alignment; Antitubercular agents; Thymidine monophosphate kinase

Indexed keywords

ENZYME INHIBITOR; PHOSPHOTRANSFERASE; THYMIDINE MONOPHOSPHATE KINASE INHIBITOR; THYMIDINE PHOSPHATE; THYMIDYLATE KINASE; UNCLASSIFIED DRUG;

ARTICLE; DRUG STRUCTURE; MYCOBACTERIUM TUBERCULOSIS; NONHUMAN; PHARMACOPHORE; REGRESSION ANALYSIS; STRUCTURE ACTIVITY RELATION; TECHNIQUE;

ANTITUBERCULAR AGENTS; COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; DRUG DESIGN; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MYCOBACTERIUM TUBERCULOSIS; NUCLEOSIDE-PHOSPHATE KINASE; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; THYMIDINE MONOPHOSPHATE;

MYCOBACTERIUM TUBERCULOSIS;

EID: 30344474006     PISSN: 0960894X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmcl.2005.10.086     Document Type: Article

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