Publications by authors named "Pavithra K Balasubramanian"

11Publications

Isorhamnetin Has Potential for the Treatment of -Induced Sepsis.

Molecules 2019 Nov 4;24(21). Epub 2019 Nov 4.

Department of Bioscience and Biotechnology, Research Institute for Bioactive-Metabolome Network, Konkuk University, Seoul 05029, Korea.

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http://dx.doi.org/10.3390/molecules24213984DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC6864442PMC
November 2019

Elucidation of the crystal structure of FabD from the multidrug-resistant bacterium Acinetobacter baumannii.

Biochem Biophys Res Commun 2018 10 20;505(1):208-214. Epub 2018 Sep 20.

Department of Bioscience and Biotechnology, Konkuk University, Seoul, 05029, Republic of Korea. Electronic address:

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https://linkinghub.elsevier.com/retrieve/pii/S0006291X183200
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http://dx.doi.org/10.1016/j.bbrc.2018.09.079DOI Listing
October 2018

3D-QSAR-aided design of potent c-Met inhibitors using molecular dynamics simulation and binding free energy calculation.

J Biomol Struct Dyn 2019 May 1;37(8):2165-2178. Epub 2018 Nov 1.

a Department of Biomedical Sciences, College of Medicine , Chosun University , Gwangju 501-759 , Republic of Korea.

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http://dx.doi.org/10.1080/07391102.2018.1479309DOI Listing
May 2019

Deciphering the crucial molecular properties of a series of Benzothiazole Hydrazone inhibitors that targets anti-apoptotic Bcl-xL protein.

J Biomol Struct Dyn 2018 Aug 24;36(10):2654-2667. Epub 2017 Aug 24.

d Department of Information Technology , University of Turku , Turku FI-20520 , Finland.

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http://dx.doi.org/10.1080/07391102.2017.1365771DOI Listing
August 2018

Receptor-guided 3D-QSAR studies, molecular dynamics simulation and free energy calculations of Btk kinase inhibitors.

BMC Syst Biol 2017 03 14;11(Suppl 2). Epub 2017 Mar 14.

Department of Biomedical Sciences, College of Medicine, Chosun University, 375 Seosuk-dong, Dong-gu, Gwangju, 61452, Republic of Korea.

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http://bmcsystbiol.biomedcentral.com/articles/10.1186/s12918
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http://dx.doi.org/10.1186/s12918-017-0385-5DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5374705PMC
March 2017

Design of Novel Chemotherapeutic Agents Targeting Checkpoint Kinase 1 Using 3D-QSAR Modeling and Molecular Docking Methods.

Curr Comput Aided Drug Des 2016 ;12(4):302-313

College of Medicine, Chosun University, 375 Seosuk-dong, Dong-gu Gwangju 501-759, Republic of Korea.

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http://dx.doi.org/10.2174/1573409912666160901112720DOI Listing
February 2017

Molecular modeling studies on series of Btk inhibitors using docking, structure-based 3D-QSAR and molecular dynamics simulation: a combined approach.

Arch Pharm Res 2016 Mar 23;39(3):328-39. Epub 2015 Dec 23.

Department of Biomedical Sciences, College of Medicine, Chosun University, 375 Seosuk-dong, Dong-gu, Gwangju, 501-759, Republic of Korea.

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http://dx.doi.org/10.1007/s12272-015-0698-0DOI Listing
March 2016

3D-QSAR study of tetrahydro-3H-imidazo[4,5-c]pyridine derivatives as VEGFR-2 kinase inhibitors using various charge schemes.

Arch Pharm Res 2015 Aug 13;38(8):1434-42. Epub 2015 Jan 13.

Department of Bio-New Drug Development, College of Medicine, Chosun University, Gwangju, 501-759, Republic of Korea.

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http://dx.doi.org/10.1007/s12272-015-0554-2DOI Listing
August 2015

In silico study of 1-(4-Phenylpiperazin-1-yl)-2-(1H-pyrazol-1-yl) ethanones derivatives as CCR1 antagonist: homology modeling, docking and 3D-QSAR approach.

Bioorg Med Chem Lett 2014 Feb 25;24(3):928-33. Epub 2013 Dec 25.

Department of Bio-New Drug Development, College of Medicine, Chosun University, Gwangju 501-759, Republic of Korea; Department of Cellular Molecular Medicine, College of Medicine, Chosun University, 375 Seosuk-dong, Dong-gu, Gwangju 501-759, Republic of Korea. Electronic address:

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http://dx.doi.org/10.1016/j.bmcl.2013.12.065DOI Listing
February 2014

In silico study on indole derivatives as anti HIV-1 agents: a combined docking, molecular dynamics and 3D-QSAR study.

Arch Pharm Res 2014 Aug 14;37(8):1001-15. Epub 2013 Dec 14.

Department of Bio-New Drug Development, College of Medicine, Chosun University, 375 Seosuk-dong, Dong-gu, Gwangju, 501-759, Republic of Korea.

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http://dx.doi.org/10.1007/s12272-013-0313-1DOI Listing
August 2014

Modeling study of phenylsulfonylfuroxan derivatives as P-gp inhibitors: a combined approach of CoMFA, CoMSIA and HQSAR.

Anticancer Agents Med Chem 2014 ;14(7):1019-30

College of Medicine, Chosun University, 375 Seosuk-dong, Dong-gu Gwangju 501-759, Republic of Korea.

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http://dx.doi.org/10.2174/18715206113136660335DOI Listing
June 2015