1. H. Surya Prakash Rao, One-Pot Synthesis of Densely Substituted Pyrazolo[3,4- b ]-4,7-dihydropyridines, , ACS Combinatorial Science, 2017, 279–285
Dr. H. Surya Prakash Rao
Dr. Basant K. Tiwary
1. Arunagiri Kuha Deva MagendhraRao, Prevalence of p53 codon 72, p73 G4C14-A4T14 and MDM2 T309G polymorphisms and its association with the risk of oral cancer in South Indians., Elsevier, , 2017, 7/106-12
2. Kumar A, Inhibition of the MurA enzyme in Fusobacterium nucleatum by potential inhibitors identified through computational and in vitro approaches., , Molecular BioSystems, 2017, 1742-2051
3. 1. A. Kumar, P.L. Thotakura, Basant K Tiwary and Ramadas Krishna , Target identification in Fusobacterium nucleatum by subtractive genomics approach and enrichment analysis of host-pathogen protein-protein interactions, , BMC microbiology, 2016, 16, 84
Dr. Dinakar R. Ampasala
1. Sapam, T. D, Identifying novel small molecule antagonists for mLST8 protein using computational approaches, , Journal of Receptors and Signal Transduction, 2017, 1–11
2. Bhagath Kumar Palaka, Molecular cloning and characterization of phosphoacetylglucosamine mutase from Bombyx mori, , Journal of Entomology and Zoology Studies, 2017, 1166-1178
Dr. P.T.V. Lakshmi
1. kumar c, A comprehensive look of poly(ADP-ribose) polymerase inhibition strategies and future directions for cancer therapy, , Future Medicinal Chemistry, 2017, 9(1), 37–60
3. Chemmugil P, Exploring the Phyto-Constituents of Ruellia patula (Acanthaceae) as Antibacterial Agent, , EC MICROBIOLOGY, 2017, 133-148
Dr. R. Krishna
1. Topno NS, Mechanistic insights into the activity of Ptf1-p48 (pancreas transcription factor 1a): probing the interactions levels of Ptf1-p48 with E2A-E47 (transcription factor E2-alpha) and ID3 (inhibitor of DNA binding 3), , Journal of Biomolecular Structure and Dynamics, 2017, 1–19
2. Pragna LakshmiT, Molecular interaction of 2 , 4 - diacetylphloroglucinol ( DAPG ) with human serum albumin ( HSA ) : The spectroscopic, , calorimetric and computational investigation, 2017, 1-7
3. T.Pragna Lakshmi, Identification of natural allosteric inhibitor for Akt1 protein through computational approaches and in vitro evaluation, , International Journal of Biological Macromolecules, 2017, 200-213
Dr. M. Suresh Kumar
1. Vikrant Kumar Sinha, Insight into the intermolecular recognition mechanism involved in complement component 4 activation through serine protease-trypsin, , Journal of Biomolecular Structure & Dynamics, 2017, 1-15
2. Subastri, A.; Durga, A.; Harikrishna, K.; Sureshkumar, M.; Jeevaratnam, K.; Girish, K. S.; Thirunavukkarasu, C, Exploration of disulfiram dealings with calf thymus DNA using spectroscopic, electrochemical and molecular docking techniques, , Journal of Luminescence, 2016, 170, 255-261;
3. Sharma, O. P.; Kumar, M. S, Essential proteins and possible therapeutic targets of Wolbachia endosymbiont and development of FiloBase-a comprehensive drug target database for Lymphatic filariasis, , Scientific reports, 2016, 6, 19842
Dr. Archana Pan
3. Pan, A.; Lahiri, C.; Rajendiran, A.; Shanmugham, B, Computational analysis of protein interaction networks for infectious diseases, Briefings in Bioinformatics, , 2015, 1,10.
Dr. R. Amutha
1. Amutha Ramaswamy†, Molecular Dynamics of Double Stranded Xylo-Nucleic Acid, , Journal of Chemical Theory and Computation , 2017, 5028–5038
2. Rajagopalan, Insights into the RNA binding mechanism of human L1-ORF1p: a molecular dynamics study. , , Molecular bioSystems, 2017, 13 (9)
3. MuthukumaranRajagopalan, Structural dynamics of Wild Type and Mutated forms of Human L1 Endonuclease and insights into its Sequence specific Nucleic acid Binding mechanism: a molecular dynamics study, , Journal of Molecular Graphics and Modelling, 2017, Volume 76, September 2017, Pages 43-55
Dr. B. Syed Ibrahim
1. GopinathSamykannu, Investigations of binding mode insight in Salmonella typhi type-III secretion system tip protein (SipD): A molecular docking and MD simulation study, , Informatics in Medicine Unlocked, 2017, Volume 9, 2017, Pages 166-172
3. PalanichamyEsakkiraj, Molecular characterization and application of lipase from Bacillus sp. PU1 and investigation of structural changes based on pH and temperature using MD simulation, , International Journal of Biological Macromolecules, 2017, Volume 103, October 2017, Pages 47-56
Dr. A. Murali
3. Mohammad Wahab Khan, Modeling of alcohol oxidase enzyme of Candida boidinii and in silico analysis of competitive binding of proton ionophores and FAD with enzyme, , Molecular BioSystems, 2017, 13 1754 1769
Dr. S. Mohane Coumar
1. Safiulla Basha Syed, Targeting P-glycoprotein: Investigation of piperine analogs for overcoming drug resistance in cancer, , scientific reports, 2017, 2045-2322 2017, 7 7972
3. Vivek Kumar Singh, Drug repurposing for chronic myeloid leukemia: in silico and in vitro investigation of DrugBank database for allosteric Bcr-Abl inhibitors., , Journal of Biomolecular Structure and Dynamics, 2017, Volume 35, 2017 - Issue 8