Kumar, Sivakumar Prasanth <br/><br/>
The effect of various atomic partial charge schemes to elucidate consensus activity-correlating molecular regions: a test case of diverse QSAR models.  [electronic resource] 

 -  Journal of biomolecular structure & dynamics  2016 
 - 540-59 p.  digital 
<br/><br/> Publication Type: Journal Article; Research Support, Non-U.S. Gov't 
<br/><br/><label>ISSN: </label>1538-0254 
<br/><br/><label>Standard No.: </label>10.1080/07391102.2015.1044474  doi 
<br/><br/><label>Subjects--Topical Terms: </label><br/>Cyclooxygenase 2--chemistry<br/>Cyclooxygenase 2 Inhibitors--chemistry<br/>Drug Design<br/>Models, Molecular<br/>Molecular Conformation<br/>Molecular Docking Simulation<br/>Molecular Dynamics Simulation<br/>Protein Binding<br/>Quantitative Structure-Activity Relationship<br/>Software