Molecular modelling studies ond-annulated benzazepinones as VEGF-R2 kinase inhibitors using docking and 3D-QSAR

3D-QSAR and docking studies on transforming growth factor (TGF)-β receptor 1 antagonists

(2010) Werner J. Geldenhuys et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

CoMFA and CoMSIA 3D-QSAR studies on quionolone caroxylic acid derivatives inhibitors of HIV-1 integrase

(2010) Peng Lu et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Identification of 2-Anilino-9-methoxy-5,7-dihydro-6H-pyrimido[5,4-d][1]benzazepin-6-ones as Dual PLK1/VEGF-R2 Kinase Inhibitor Chemotypes by Structure-Based Lead Generation

(2010) Anne-Marie Egert-Schmidt et al.   JOURNAL OF MEDICINAL CHEMISTRY

Exploring 3D-QSAR for Ketolide Derivatives as Antibacterial Agents Using CoMFA and CoMSIA

(2010) Qiu-Ling Song et al.   Letters in Drug Design & Discovery

Receptor- and ligand-based 3D-QSAR study for a series of non-nucleoside HIV-1 reverse transcriptase inhibitors

(2009) Rongjing Hu et al.   BIOORGANIC & MEDICINAL CHEMISTRY

CoMFA, LeapFrog and blind docking studies on sulfonanilide derivatives acting as selective aromatase expression regulators

(2009) Carlos Gueto et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Docking and 3D-QSAR studies of BMS-806 analogs as HIV-1 gp120 entry inhibitors

(2009) C. Teixeira et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Application of 3D QSAR CoMFA/CoMSIA and in silico docking studies on novel renin inhibitors against cardiovascular diseases

(2009) Aggeliki Politi et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

3D QSAR studies on ketoamides of human cathepsin K inhibitors based on two different alignment methods

(2009) Xulin Pan et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Docking and 3D-QSAR studies of influenza neuraminidase inhibitors using three-dimensional holographic vector of atomic interaction field analysis

(2009) Jiaying Sun et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Docking-based 3D-QSAR study for 11β-HSD1 inhibitors

(2008) Jin Hee Lee et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Thiocarbamates as non-nucleoside HIV-1 reverse transcriptase inhibitors: Docking-based CoMFA and CoMSIA analyses

(2008) Elena Cichero et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Development of CoMFA and CoMSIA models of cytotoxicity data of anti-HIV-1-phenylamino-1H-imidazole derivatives

(2008) Arijit Basu et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Design, synthesis and characterization of N9/N7-substituted 6-aminopurines as VEGF-R and EGF-R inhibitors

(2008) Christian Peifer et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Design, Synthesis, and Biological Evaluation of Novel 3-Aryl-4-(1H-indole-3yl)-1,5-dihydro-2H-pyrrole-2-ones as Vascular Endothelial Growth Factor Receptor (VEGF-R) Inhibitors

(2008) Christian Peifer et al.   JOURNAL OF MEDICINAL CHEMISTRY

A combination of 3D-QSAR, docking, local-binding energy (LBE) and GRID study of the species differences in the carcinogenicity of benzene derivatives chemicals

(2008) Filip Fratev et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Molecular modeling studies of vascular endothelial growth factor receptor tyrosine kinase inhibitors using QSAR and docking

(2008) Juan Du et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Molecular modeling studies of phenoxypyrimidinyl imidazoles as p38 kinase inhibitors using QSAR and docking☆

(2007) G.K. Ravindra et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

On Some Aspects of Variable Selection for Partial Least Squares Regression Models

(2007) Partha Pratim Roy et al.   Quantitative structure-activity relationships & combinatorial science