Research Articles

  • Shiv Bharadwaj, Amit Dubey, Umesh Yadava, Sarad Kumar Mishra, Sang Gu Kang, Vivek Dhar Dwivedi (2021). Exploration of natural compounds with anti-SARS-CoV-2 activity via inhibition of SARS-CoV-2 Mpro. Briefings in bioinformatics. DOI: 10.1093/bib/bbaa382. Read more
  • Shiv Bharadwaj, Esam Ibraheem Azhar, Mohammad Amjad Kamal, Leena Hussein Bajrai, Amit Dubey, Kanupriya Jha, Umesh Yadava, Sang Gu Kang & Vivek Dhar Dwivedi (2020) SARS-CoV-2 Mpro inhibitors: identification of anti-SARS-CoV-2 Mpro compounds from FDA approved drugs, Journal of Biomolecular Structure and Dynamics. DOI: 10.1080/07391102.2020.1842807. Read more
  • Aditya Arya & Vivek Dhar Dwivedi (2020) Synergistic effect of vitamin D and remdesivir can fight COVID-19, Journal of Biomolecular Structure and Dynamics. DOI: 10.1080/07391102.2020.1773929. Read more
  • Shiv Bharadwaj, Kyung Eun Lee, Vivek Dhar Dwivedi, Sang Gu Kang (2020). Computational insights into tetracyclines as inhibitors against SARS-CoV-2 Mpro via combinatorial molecular simulation calculations, Life Sciences, DOI: 10.1016/j.lfs.2020.118080. Read more
  • Hayate Javed, MF Meeran, Sheikh Azimullah, Lujain Bader Eddin, Vivek Dhar Dwivedi, Niraj Kumar Jha, Shreesh Ojha (2020). α-Bisabolol, a Dietary Bioactive Phytochemical Attenuates Dopaminergic Neurodegeneration through Modulation of Oxidative Stress, Neuroinflammation and Apoptosis in Rotenone-Induced Rat Model of Parkinson’s Disease. Biomolecules. DOI: 10.3390/biom10101421. Read more
  • Vivek Dhar Dwivedi, Aditya Arya, Pardeep Kumar, Rajesh Kumar, Gajendrs PS Raghava (2020). DenvInD: Dengue Virus Inhibitors Database for Clinical and Molecular Research. Briefings in Bioinformatics. DOI: 10.1093/bib/bbaa098. Read more
  • Vivek Dhar Dwivedi, Aditya Arya, Tanuj Sharma, Shweta Sharma, Shripad A. Patil & Vivek Kumar Gupta (2020). Computational investigation of phytomolecules as resuscitation-promoting factor B (RpfB) inhibitors for clinical suppression of Mycobacterium tuberculosis dormancy reactivation. Infection, Genetics and Evolution. DOI: 10.1016/j.meegid.2020.104356 Read more
  • Pooja Mahajan, Shantanu Tomar, Adarsh Kumar, Nilesh Yadav, Aditya Arya, & Vivek Dhar Dwivedi (2020). A multi-target approach for discovery of antiviral compounds against dengue virus from green tea. Network Modeling Analysis in Health Informatics and Bioinformatics, 9(1), 1-10. DOI: 10.1007/s13721-020-0222-4 Read more
  • Shiv Bharadwaj, Kyung EunLee, Vivek Dhar Dwivedi, Umesh Yadava, Matthias Nees, Sang GuKang (2020). Density functional theory and molecular dynamics simulation support Ganoderma lucidum triterpenoids as broad range antagonist of matrix metalloproteinases. Journal of Molecular Liquids. DOI: 10.1016/j.molliq.2020.113322 Read more
  • Shiv Bharadwaj, Akhilesh Kumar Rao, Vivek Dhar Dwivedi, Sarad Kumar Mishra & Umesh Yadava. (2020). Structure-based screening and validation of bioactive compounds as Zika virus Methyltransferase (MTase) inhibitors through first-principle density functional theory, classical molecular simulation and QM/MM affinity estimation. Journal of Biomolecular Structure and Dynamics. DOI: 10.1080/07391102.2020.1747545. Read more
  • Vivek Dhar Dwivedi, Shiv Bharadwaj, Sumbul Afroz, Nooruddin Khan, Mairaj Ahmed Ansari, Umesh Yadava, Ramesh Chandra Tripathi, Indra Prasad Tripathi, Sarad Kumar Mishra & Sang Gu Kang (2020). Anti-Dengue infectivity evaluation of bioflavonoid from Azadirachta indica by dengue virus serine protease inhibition. Journal of Biomolecular Structure and Dynamics. DOI: 10.1080/07391102.2020.1734485 Read more
  • Bharadwaj S, Lee KE, Dwivedi VD, Yadava U, Panwar A, Lucas SJ, Pandey A, Kang SG (2019). Discovery of Ganoderma lucidum triterpenoids as potential inhibitors against Dengue virus NS2B-NS3 protease. Scientific reports. 9(1):1-12. Read more
  • Arya A,Singh S, Dwivedi VD, Shakila H, (2019), Integration of biometric ID for the effective 1 collection and epidemiological evaluation of antibiotic prescription in tuberculosis and other diseases: A medical hypothesis. Journal of Global Antimicrobial Resistance. Read more
  • Bharadwaj S, Lee KE, Dwivedi VD, Yadava U, Kang SG, (2019). Computational aided mechanistic understanding of Camellia sinensis bioactive compounds against co‐chaperone p23 as potential anticancer agent. Journal of cellular biochemistry. Read more
  • Raghava GPS, Nagpal G, Usmani SS, (2018). A web resource for designing subunit vaccine against major pathogenic species of bacteria. Frontiers in immunology. Read more

Books | Book chapters | Review Articles

  • Bharadwaj S, Dwivedi VD, Kirtipal N. Chapter 07: Application of Whole Genome Sequencing (WGS) Approach Against Identification of Foodborne Bacteria. Microbial Genomics in Sustainable Agroecosystems, Springer, 2019. Vol-1: 131-141; ISBN 978-981-13-8738-8.
  • Kumar, P and Mina, U. Fundamentals of Ecology and Environment. Pathfinder Publication 2018, ISBN : 978-8-19-346550-9

Conference Abstracts | Proceedings

  • Dwivedi VD. Discovery of new potential anti-dengue compounds from Azadirachta indica. The National Academy of Sciences at MGCGV Chitrakoot, 08-10 December 2018.