Novel glitazones as PPARγ agonists: molecular design, synthesis, glucose uptake activity and 3D QSAR studies

A comprehensive review of the FDA-approved labels of diabetes drugs: Indications, safety, and emerging cardiovascular safety data

(2017) Evgenia Gourgari et al.   JOURNAL OF DIABETES AND ITS COMPLICATIONS

Novel rhodanines with anticancer activity: design, synthesis and CoMSIA study

(2016) Subhankar P. Mandal et al.   RSC Advances

Bringing the MMFF force field to the RDKit: implementation and validation

(2014) Paolo Tosco et al.   Journal of Cheminformatics

Synthesis and Hypolipidemic Activity of Novel 2-(4-(2-Amino-6-(4-Substituted Phenyl) Pyrimidin-4-yl)-2-Substituted Phenoxy) Acetic Acid Derivatives

(2012) Santosh N. Mokale et al.   Chemical Biology & Drug Design

SwissParam: A fast force field generation tool for small organic molecules

(2011) Vincent Zoete et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

3D-QSAR studies on purine-carbonitriles as cruzain inhibitors: comparative molecular field analysis (CoMFA) and comparative molecular similarity indices analysis (CoMSIA)

(2011) Oscar Méndez-Lucio et al.   MedChemComm

Therapeutic Potential of Aleglitazar, a New Dual PPAR-α/γ Agonist

(2010) Matthew A. Cavender et al.   American Journal of Cardiovascular Drugs

Pharmacophore modeling and applications in drug discovery: challenges and recent advances

(2010) Sheng-Yong Yang   DRUG DISCOVERY TODAY

A comparison of different electrostatic potentials on prediction accuracy in CoMFA and CoMSIA studies

(2010) Keng-Chang Tsai et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Protein tyrosine phosphatases as drug targets: strategies and challenges of inhibitor development

(2010) Alastair J Barr   Future Medicinal Chemistry

Implementation of the CHARMM Force Field in GROMACS: Analysis of Protein Stability Effects from Correction Maps, Virtual Interaction Sites, and Water Models

(2010) Pär Bjelkmar et al.   Journal of Chemical Theory and Computation

Synthesis and Anti-Bacterial Activities of Some Novel Schiff Bases Derived from Aminophenazone

(2010) Abdullah M. Asiri et al.   MOLECULES

PPARs: Nuclear Receptors Controlled by, and Controlling, Nutrient Handling through Nuclear and Cytosolic Signaling

(2010) Maria Moreno et al.   PPAR Research

Diabetes prevalence and its risk factors in urban Pondicherry

(2009) SanjayKumar Gupta et al.   International Journal of Diabetes in Developing Countries

GROMACS 4:  Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

(2008) Berk Hess et al.   Journal of Chemical Theory and Computation