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2. Krishna Kant Gupta, Scale-up and inhibitory studies on productivity of lipase from Acinetobacter radioresistens PR8, , Journal of Bioscience and Bioengineering, 2017, 150–155
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
4. Mondal, M, Molecular interaction between human serum albumin (HSA) and phloroglucinol derivative that shows selective anti-proliferative potential. Journal of Luminescence, , Journal of Luminescence, 2017, 990–998
5. Safiulla Basha Syed, Targeting P-glycoprotein: Investigation of piperine analogs for overcoming drug resistance in cancer, , scientific reports, 2017, 2045-2322 2017, 7 7972
6. 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
8. Pragna LakshmiT, Molecular interaction of 2 , 4 - diacetylphloroglucinol ( DAPG ) with human serum albumin ( HSA ) : The spectroscopic, , calorimetric and computational investigation, 2017, 1-7
9. 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
10. 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
12. H. Surya Prakash Rao, One-Pot Synthesis of Densely Substituted Pyrazolo[3,4- b ]-4,7-dihydropyridines, , ACS Combinatorial Science, 2017, 279–285
14. Chayanika Goswami, Modeling, Molecular Dynamics Simulation and Essential Dynamics on Anopheles gambiae D7r1, , International Journal of Biochemistry and Biophysics, 2017, Vol. 5(3),
15. MamtaVerma, PRMT7 Interacts with ASS1 and Citrullinemia Mutations Disrupt the Interaction., , Journal of Molecular Biology, , 2017, Volume 429, Issue 15, 21 July 2017, Pages 2278-2289
16. 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
21. Gopichand Chinta, Reversible Testicular Toxicity of Piperine on Male Albino Rats., , Pharmacogn. Mag., , 2017, Year : 2017 | Volume : 13 | Issue : 51 | Page : 525-532
22. Amutha Ramaswamy†, Molecular Dynamics of Double Stranded Xylo-Nucleic Acid, , Journal of Chemical Theory and Computation , 2017, 5028–5038
24. Rajagopalan, Insights into the RNA binding mechanism of human L1-ORF1p: a molecular dynamics study. , , Molecular bioSystems, 2017, 13 (9)
25. 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
27. 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
28. 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
30. Sapam, T. D, Identifying novel small molecule antagonists for mLST8 protein using computational approaches, , Journal of Receptors and Signal Transduction, 2017, 1–11
32. Muthukumaran Rajagopalan, Structural dynamics of nucleosome mediated by acetylations at H3K56 and H3K115,122, , European Biophysics Journal, 2017, July 2017, Volume 46, Issue 5, pp 471–484
33. Bhagath Kumar Palaka, Molecular cloning and characterization of phosphoacetylglucosamine mutase from Bombyx mori, , Journal of Entomology and Zoology Studies, 2017, 1166-1178
34. Ikrormi Rungsung , Insights into the structural dynamics of Liver kinase B1 (LKB1) by the binding of STe20 Related Adapterα (STRADα) and Mouse protein 25α (MO25α) co-activators, , Journal of Biomolecular Structure & Dynamics, 2017, 35(5), 1138–1152.
36. 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
37. Kasi ViswanathKotapati, Alleviation of nickel toxicity in finger millet (Eleusine coracana L.) germinating seedlings by exogenous application of salicylic acid and nitric oxide, Elsevier, , 2017, Vol.5(3), 240-250
39. 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
40. 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
43. Chemmugil P, Exploring the Phyto-Constituents of Ruellia patula (Acanthaceae) as Antibacterial Agent, , EC MICROBIOLOGY, 2017, 133-148
47. Hsing-Pang Hsieh, Mohane Selvaraj Coumar, John T.-A. Hsu, Su-Ying Wu and Yu-Sheng Chao, FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS, , , 2016, US8138194B2
48. Hsing-Pang Hsieh, Mohane Selvaraj Coumar and Yu-Sheng Chao, FUSED MULTICYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS, , , 2016, EP2331530B1
50. Mohankumar, K.; Sridharan, S.; Pajaniradje, S.; Singh, V. K.; Ronsard, L.; Banerjea, A. C.; Somasundaram, D. B.; Coumar, M. S.; Periyasamy, L.; Rajagopalan, R.,, BDMC-A, an analog of curcumin, inhibits markers of invasion, angiogenesis, and metastasis in breast cancer cells via NF-?B pathway-A comparative study with curcumin, , Biomedicine & Pharmacotherapy, 2016, 74, 178-186;

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