Pharmacophore modeling, molecular docking, and molecular dynamics simulation approaches for identifying new lead compounds for inhibiting aldose reductase 2

Pharmacophore based virtual screening, molecular docking studies to design potent heat shock protein 90 inhibitors

(2011) Sugunadevi Sakkiah et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

3D QSAR pharmacophore based virtual screening and molecular docking for identification of potential HSP90 inhibitors

(2010) Sugunadevi Sakkiah et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Structure-Based Optimization of Aldose Reductase Inhibitors Originating from Virtual Screening

(2009) Michael Eisenmann et al.   ChemMedChem

Aldose reductase: A novel therapeutic target for inflammatory pathologies

(2009) Kota V. Ramana et al.   INTERNATIONAL JOURNAL OF BIOCHEMISTRY & CELL BIOLOGY

CHARMM: The biomolecular simulation program

(2009) B. R. Brooks et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

X-Ray-Radiation-Induced Cooperative Atomic Movements in Protein

(2009) Tatiana Petrova et al.   JOURNAL OF MOLECULAR BIOLOGY