| Development of OPLS-AA force field parameters for 68 unique ionic liquids SV Sambasivarao, O Acevedo Journal of chemical theory and computation 5 (4), 1038-1050, 2009 | 519 | 2009 |
| Synthesis and antimicrobial activity of some new 2-substituted aminothiazoles B Sutariya, SK Raziya, S Mohan, SV Sambasivarao INDIAN JOURNAL OF CHEMISTRY SECTION B 46 (5), 884, 2007 | 40 | 2007 |
| An ionic liquid dependent mechanism for base catalyzed β-elimination reactions from QM/MM simulations C Allen, SV Sambasivarao, O Acevedo Journal of the American Chemical Society 135 (3), 1065-1072, 2013 | 36 | 2013 |
| Quantitative structure–activity analysis of 5-arylidene-2, 4-thiazolidinediones as aldose reductase inhibitors SV Sambasivarao, LK Soni, AK Gupta, P Hanumantharao, ... Bioorganic & medicinal chemistry letters 16 (3), 512-520, 2006 | 32 | 2006 |
| A combined theoretical and experimental investigation of the transport properties of water in a perfluorosulfonic acid proton exchange membrane doped with the heteropoly acids … Y Liu, SV Sambasivarao, JL Horan, Y Yang, CM Maupin, AM Herring The Journal of Physical Chemistry C 118 (2), 854-863, 2014 | 30 | 2014 |
| Identification of HIV inhibitors guided by free energy perturbation calculations SV Sambasivarao Curr. Pharm. Des 18 (9), 1199-1216, 2013 | 28 | 2013 |
| Construction of Donor–Acceptor Polymers via Cyclopentannulation of Poly (arylene ethynylene) s X Zhu, SR Bheemireddy, SV Sambasivarao, PW Rose, R Torres Guzman, ... Macromolecules 49 (1), 127-133, 2016 | 25 | 2016 |
| Identification of HIV inhibitors guided by free energy perturbation calculations O Acevedo, Z Ambrose, P T Flaherty, H Aamer, P Jain, S V Sambasivarao Current pharmaceutical design 18 (9), 1199-1216, 2012 | 25 | 2012 |
| Acetylcholine Promotes Binding of α‐Conotoxin MII at α3β2 Nicotinic Acetylcholine Receptors SV Sambasivarao, J Roberts, VS Bharadwaj, JG Slingsby, C Rohleder, ... ChemBioChem 15 (3), 413-424, 2014 | 23 | 2014 |
| Enhancing proton transport and membrane lifetimes in perfluorosulfonic acid proton exchange membranes: a combined computational and experimental evaluation of the structure and … SV Sambasivarao, Y Liu, JL Horan, S Seifert, AM Herring, CM Maupin The Journal of Physical Chemistry C 118 (35), 20193-20202, 2014 | 22 | 2014 |
| Optimal scaling factors for CM1 and CM3 atomic charges in RM1‐based aqueous simulations JZ Vilseck, SV Sambasivarao, O Acevedo Journal of computational chemistry 32 (13), 2836-2842, 2011 | 20 | 2011 |
| Computational insight into small molecule inhibition of cyclophilins SV Sambasivarao, O Acevedo Journal of chemical information and modeling 51 (2), 475-482, 2011 | 20 | 2011 |
| QSAR analysis of thiazole benzenesulfonamide substituted 3-pyridylethanolamines as β3-adrenergic receptor agonist P Hanumantharao, SV Sambasivarao, LK Soni, AK Gupta, ... Bioorganic & medicinal chemistry letters 15 (12), 3167-3173, 2005 | 20 | 2005 |
| Identifying the enzymatic mode of action for cellulase enzymes by means of docking calculations and a machine learning algorithm SV Sambasivarao, DM Granum, H Wang, CM Maupin AIMS Molecular Science 1 (1), 59-80, 2014 | 11 | 2014 |
| Homology modeling and molecular docking for the science curriculum OM McDougal, N Cornia, SV Sambasivarao, A Remm, C Mallory, ... Biochemistry and Molecular Biology Education 42 (2), 179-182, 2014 | 10 | 2014 |
| Computational Evaluations of Charge Coupling and Hydrogen Bonding in the Active Site of a Family 7 Cellobiohydrolase DM Granum, S Vyas, SV Sambasivarao, CM Maupin The Journal of Physical Chemistry B 118 (2), 434-448, 2014 | 9 | 2014 |
| QSAR analysis of analogs of bis [2-(acylamino) phenyl] disulfides, 2-(acylamino) benzenethiols and S-[2-(acylamino) phenyl] alkanethioates as antihyperlipidemic agents P Hanumantharao, SV Sambasivarao, LK Soni, AK Gupta, ... CSIR, 2005 | 9 | 2005 |
| Optimization of Small Molecules That Sensitize HIV-1 Infected Cells to Antibody-Dependent Cellular Cytotoxicity ABSIII Melissa C. Grenier, Shilei Ding, Dani Vézina, Jean-Philippe Chapleau ... ACS Med. Chem. Lett., 2019 | 8* | 2019 |
| 3D-QSAR analysis of some cinnamic acid derivatives as antimalarial agents AK Gupta, LK Soni, P Hanumantharao, SV Sambasivarao, MA Babu, ... Asian Journal of Chemistry 16 (1), 67, 2004 | 7 | 2004 |
| Thermal Stability and Ionic Conductivity of High-Temperature Proton Conducting Ionic Liquid− Polymer Composite Electrolyte Membranes for Fuel Cell Applications SV Sambasivarao Polymer Composites for Energy Harvesting, Conversion, and Storage, 111-126, 2014 | 6 | 2014 |
Orlando AcevedoUniversity of Miami, Department of ChemistryVerifierad e-postadress på miami.edu
