| Absolute binding free energy calculations: On the accuracy of computational scoring of protein–ligand interactions N Singh, A Warshel Proteins: Structure, Function, and Bioinformatics 78 (7), 1705-1723, 2010 | 255 | 2010 |
| Targeting the methyl erythritol phosphate (MEP) pathway for novel antimalarial, antibacterial and herbicidal drug discovery: inhibition of 1-deoxy-D-xylulose-5-phosphate … N Singh, G Cheve, MA Avery, CR McCurdy Current pharmaceutical design 13 (11), 1161-1177, 2007 | 160 | 2007 |
| p-Hydroxyphenylpyruvate dioxygenase is a herbicidal target site for β-triketones from Leptospermum scoparium FE Dayan, SO Duke, A Sauldubois, N Singh, C McCurdy, C Cantrell Phytochemistry 68 (14), 2004-2014, 2007 | 151 | 2007 |
| A comprehensive examination of the contributions to the binding entropy of protein–ligand complexes N Singh, A Warshel Proteins: Structure, Function, and Bioinformatics 78 (7), 1724-1735, 2010 | 66 | 2010 |
| A combined ligand-based and target-based drug design approach for G-protein coupled receptors: application to salvinorin A, a selective kappa opioid receptor agonist N Singh, G Chevé, DM Ferguson, CR McCurdy Journal of computer-aided molecular design 20, 471-493, 2006 | 62 | 2006 |
| β-Triketone Inhibitors of Plant p-Hydroxyphenylpyruvate Dioxygenase: Modeling and Comparative Molecular Field Analysis of Their Interactions FE Dayan, N Singh, CR McCurdy, CA Godfrey, L Larsen, RT Weavers, ... Journal of agricultural and food chemistry 57 (12), 5194-5200, 2009 | 43 | 2009 |
| Toward accurate microscopic calculation of solvation entropies: extending the restraint release approach to studies of solvation effects N Singh, A Warshel The Journal of Physical Chemistry B 113 (20), 7372-7382, 2009 | 35 | 2009 |
| Comparative Protein Modeling of 1-Deoxy-d-xylulose-5-phosphate Reductoisomerase Enzyme from Plasmodium f alciparum: A Potential Target for Antimalarial Drug Discovery N Singh, G Chevé, MA Avery, CR McCurdy Journal of chemical information and modeling 46 (3), 1360-1370, 2006 | 33 | 2006 |
| Chemical function-based pharmacophore development for novel, selective kappa opioid receptor agonists N Singh, TL Nolan, CR McCurdy Journal of Molecular Graphics and Modelling 27 (2), 131-139, 2008 | 19 | 2008 |
| Toward Mycobacterium tuberculosis DXR inhibitor design: homology modeling and molecular dynamics simulations N Singh, MA Avery, CR McCurdy Journal of computer-aided molecular design 21, 511-522, 2007 | 19 | 2007 |
| Validating the vitality strategy for fighting drug resistance N Singh, MP Frushicheva, A Warshel Proteins: Structure, Function, and Bioinformatics 80 (4), 1110-1122, 2012 | 14 | 2012 |
| Ligand macromolecule interactions: theoretical principles of molecular recognition T Nolan, N Singh, CR McCurdy Ligand-Macromolecular Interactions in Drug Discovery. Methods in Molecular …, 2010 | 10 | 2010 |
| QSAR studies in substituted 1, 2, 3, 4, 6, 7, 12, 12a-octa-hydropyrazino [2′, 1′: 6, 1] pyrido [3, 4-b] indoles—a potent class of neuroleptics AK Saxena, S Ram, M Saxena, N Singh, P Prathipati, PC Jain, HK Singh, ... Bioorganic & medicinal chemistry 11 (9), 2085-2090, 2003 | 9 | 2003 |
| SAR analysis of new dual targeting fluoroquinolones. Implications of the benzenesulfonyl group M J Nieto, A B Pierini, N Singh, C R McCurdy, R H Manzo, R Mazzieri Medicinal Chemistry 8 (3), 349-360, 2012 | 6 | 2012 |
| Computer-assisted detection and diagnosis of pediatric pneumonia in chest X-ray images I Mohammed, N Singh, M Venkatasubramanian | 4 | 2019 |
| On the road to personalized medicine: Discovery of prognostic high-order interactions in breast cancer N Singh, M Venkatasubramanian, I Mohammed, M Dushkoff, B Brown | 1 | 2018 |
| A Machine Learning Approach to Pattern Discovery in Oncogenomics I Mohammed, N Singh, M Venkatasubramanian | | 2019 |
| Inhibitors of hexokinase and methods of use thereof A Mjalli, B Gaddam, D Gohimukkula, D Polisetti, M Rao, M Guzel, N Singh, ... WO Patent 2016196890 A1, 2016 | | 2016 |
| Development of the first predictive pharmacophore models for sigma-1 and sigma-2 receptor antagonists N Singh, C Mesangeau, S Narayanan, J Shaikh, RR Matsumoto, ... ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 233, 748-748, 2007 | | 2007 |
| Part A. Protein Modeling in Rational Drug Design: Case Study with Deoxyxylulose Phosphate Reductoisomerase Enzyme. Part B. Delineating a Powerful Virtual Screening Approach for … N Singh ProQuest, 2007 | | 2007 |
Mitchell A. AveryProfessor of Medicinal Chemistry, Emeritus在 olemiss.edu 的电子邮件经过验证
