| Frontiers in Protein Structure, Function, and Dynamics DB Singh, T Tripathi Springer, Singapore 1, 452, 2020 | 71 | 2020 |
| Molecular docking and molecular dynamics simulation S Singh, QB Baker, DB Singh Bioinformatics, 291-304, 2022 | 60 | 2022 |
| Identification of potential inhibitors of Fasciola gigantica thioredoxin1: Computational screening, molecular dynamics simulation and binding free energy studies TT Rohit Shukla, Harish Shukla, Parismita Kalita, Amit Sonkar, Tripti Pandey ... Journal of Biomolecular Structure and Dynamics, 2017 | 52* | 2017 |
| Protein structure prediction S Agnihotry, RK Pathak, DB Singh, A Tiwari, I Hussain Bioinformatics, 177-188, 2022 | 49 | 2022 |
| Exploring Medicinal Plant Legacy for Drug Discovery in Post-genomic Era S Singh, DB Singh, S Singh, R Shukla, PW Ramteke, K Misra Proceedings of the National Academy of Sciences, India Section B: Biological …, 2018 | 48 | 2018 |
| Docking and in silico ADMET studies of noraristeromycin, curcumin and its derivatives with Plasmodium falciparum SAH hydrolase: A molecular drug target … DB Singh, MK Gupta, DV Singh, SK Singh, K Misra Interdisciplinary Sciences: Computational Life Sciences 5, 1-12, 2013 | 44 | 2013 |
| Machine learning approaches and their applications in drug discovery and design S Priya, G Tripathi, DB Singh, P Jain, A Kumar Chemical Biology & Drug Design 100 (1), 136-153, 2022 | 31 | 2022 |
| Comparative docking and ADMET study of some curcumin derivatives and herbal congeners targeting β-amyloid DB Singh, MK Gupta, RK Kesharwani, K Misra Network Modeling and Analysis in Health Informatics and Bioinformatics 2 (1 …, 2013 | 29 | 2013 |
| Computer-Aided Drug Design DB Singh Springer 1, 306, 2020 | 27 | 2020 |
| The Impact of Pharmacogenomics in Personalized Medicine DB Singh Advances in Biochemical Engineering/Biotechnology, 2019 | 25 | 2019 |
| Computational Approaches in Drug Discovery and Design RK Pathak, SD Bukhsh, M Sagar, KA Bauthiyal, Mamta Computer-Aided Drug Design, 1-21, 2020 | 24 | 2020 |
| Drug targets and therapies for Alzheimer’s disease DB Singh, MK Gupta, RK Kesharwani, M Sagar, S Dwivedi, K Misra Translational Neuroscience 5 (3), 203-217, 2014 | 24 | 2014 |
| From traditional herbal medicine to rational drug discovery: strategies, challenges, and future perspectives DB Singh, RK Pathak, D Rai Revista Brasileira de Farmacognosia 32 (2), 147-159, 2022 | 23 | 2022 |
| Computational Approaches in Drug Designing and Their Applications DB Singh, RK Pathak Experimental Protocols in Biotechnology, 95-117, 2020 | 23 | 2020 |
| Perspectives and challenges of tropical medicinal herbs and modern drug discovery in the current scenario RK Kesharwani, DB Singh, K Misra Asian Pacific Journal of Tropical Medicine 12 (1), 1-7, 2019 | 19 | 2019 |
| Structural insight into binding mode of inhibitor with SAHH of Plasmodium and human: interaction of curcumin with anti-malarial drug targets DB Singh, S Dwivedi Journal of Chemical Biology 9 (4), 107-120, 2016 | 19 | 2016 |
| Success, limitation and future of computer aided drug designing DB Singh Translational Medicine 4 (4), 2014 | 19 | 2014 |
| Nutritional significance and antioxidant-mediated antiaging effects of finger millet: molecular insights and prospects A Kumar, M Rani, S Mani, P Shah, DB Singh, H Kudapa, RK Varshney Frontiers in Sustainable Food Systems 5, 684318, 2021 | 18 | 2021 |
| Functional classification and biochemical characterization of a novel rho class glutathione S-transferase in Synechocystis PCC 6803 T Pandey, G Chhetri, R Chinta, B Kumar, DB Singh, T Tripathi, AK Singh FEBS Open Bio, 2014 | 18 | 2014 |
| An Approach for Identification of Novel Drug Targets in Streptococcus pyogenes SF370 Through Pathway Analysis S Satendra, S Dev Bukhsh, S Anamika, G Budhayash, R Gurudayal, ... Interdisciplinary Sciences Computational Life Sciences, 2016 | 16 | 2016 |
