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Molecular Informatics

Volumn 31, Issue 6-7, 2012, Pages 459-471

Molecular docking study based on pharmacophore modeling for novel phosphodiesteraseIV inhibitors

(3) Çifci, Gülşah a Aviyente, Viktorya a Akten, E Demet b

a BOGAZICI UNIVERSITY (Turkey)

b KADIR HAS UNIVERSITY (Turkey)

Author keywords

Molecular docking; Pharmacophore modeling; PhosphodiesteraseIV inhibitors

Indexed keywords

ESTERS; MOLECULAR MODELING; PHARMACODYNAMICS;

AUTODOCK; CHEMICAL DATABASE; DOCKING STUDIES; KEY RESIDUES; MOLECULAR DOCKING; PHARMACOPHORE MODELS; PHARMACOPHORES; PHOSPHODIESTERASEIV INHIBITOR; POTENT INHIBITOR; VIRTUAL SCREENING;

CONFORMATIONS;

4 (3 CHLOROPHENYL) 1,7 DIETHYLPYRIDO[2,3 D]PYRIMIDIN 2(1H) ONE; AROFYLLINE; ATIZORAM; CILOMILAST; CIPAMFYLLINE; DAXALIPRAM; DOXOFYLLINE; FILAMINAST; IBUDILAST; ISOBUTYLMETHYLXANTHINE; LIRIMILAST; N (3,5 DICHLORO 4 PYRIDYL) [1 (4 FLUOROBENZYL) 5 HYDROXY 3 INDOLYL]GLYOXYLIC ACID AMIDE; PHOSPHODIESTERASE IV INHIBITOR; PICLAMILAST; ROFLUMILAST; ROLIPRAM; TETOMILAST; THEOPHYLLINE; TOFIMILAST; ZARDAVERINE;

ARTICLE; BINDING AFFINITY; BINDING SITE; CRYSTAL STRUCTURE; DRUG CONFORMATION; HYDROGEN BOND; MOLECULAR DOCKING; PHARMACOPHORE; PHYSICAL CHEMISTRY; PRIORITY JOURNAL;

EID: 84864198471 PISSN: 18681743 EISSN: 18681751 Source Type: Journal
DOI: 10.1002/minf.201100141 Document Type: Article

Times cited : (7)

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