Ministry of Education
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Dr Debashree Chakraborty

vidwan id: 54551
Female

Assistant Professor, Chemistry
National Institute of Technology Karnataka

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Expertise

  • Physical Chemistry

Publications

Total Articles 49
Books 0
Proceedings 0

Publications

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Scopus

Citations 765
h-index 16

CrossRef

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Citations 569
h-index 13
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Bio

Theoretical Chemistry and Biophysics

Personal Details

  • Female
  • Assistant Professor , National Institute of Technology Karnataka
  • P. O. Srinivasnagar, Mangalore
Ph.D
Indian Institute of Technology Kanpur 2011
Assistant Professor Apr 2015 – Present
National Institute of Technology Karnataka | Chemistry

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Co-Authors (8)

Amalendu

Prof Amalendu Chandra

Indian Institute of Technology Kanpur

Amit

Dr Amit Nag

Birla Institute of Technology and Science

Bhabani Shankar

Prof Bhabani Shankar Mallik

Indian Institute of Technology Hyderabad

Arun Mohan

Prof Arun Mohan Isloor

National Institute of Technology Karnataka

P E

Dr P E Jagadeeshbabu

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Kalyan K

Dr Kalyan K Sadhu

Indian Institute of Technology Roorkee

Sadasivam

Dr Sadasivam Manogaran

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Snehasis

Dr Snehasis Chowdhuri

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Scholarly Work

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Scholarly Publications

Understanding the role of water on temperature-dependent structural modifications of SARS CoV-2 main protease binding sites

Open Access
Article
Journal of Molecular Liquids. Year: 2022. Volume: 363 .
Authors: Venugopal P.P.;Singh O.;Chakraborty D.
DOI 10.1016/j.molliq.2022.119867
3

2,5-Bis(2,2,2-trifluoroethoxy)phenyl-tethered 1,3,4-Oxadiazoles Derivatives: Synthesis, In Silico Studies, and Biological Assessment as Potential Candidates for Anti-Cancer and Anti-Diabetic Agent

Open Access
Article
Year: 2022. Volume: 27 , Issue: 24 .
Authors: Shankara S.D.;Isloor A.M.;Kudva A.K.;Raghu S.V.;Jayaswamy P.K.;Venugopal P.P.;Shetty P.;Chakraborty D.
DOI 10.3390/molecules27248694
9

Temperature-Dependent Conformational Evolution of SARS CoV-2 RNA Genome Using Network Analysis

Open Access
Article
Year: 2021. Volume: 125 , Issue: 38 , Pages: 10672-10681 .
Authors: Singh O.;Venugopal P.P.;Mathur A.;Chakraborty D.
DOI 10.1021/acs.jpcb.1c05795
2 3

Preferential binding affinity of ions and their effect on structure and dynamics of water near antimicrobial peptide

Open Access
Article
Journal of Molecular Liquids. Year: 2021. Volume: 344 .
Authors: Singh O.;Chakraborty D.
DOI 10.1016/j.molliq.2021.117789
2 10

Diverse interactions of aggregated insulin with selected coumarin dyes: Time dependent fluorogenicity, simulation studies and comparison with thioflavin T

Open Access
Article
Dyes and Pigments. Year: 2021. Volume: 184 .
Authors: Dalal S.;Das B.K.;Saini M.;Chakraborty D.;Sadhu K.K.
DOI 10.1016/j.dyepig.2020.108796
1 2

Theoretical insights into molecular mechanism and energy criteria of PARP-2 enzyme inhibition by benzimidazole analogues

Open Access
Article
Year: 2021. Volume: 89 , Issue: 8 , Pages: 988-1004 .
Authors: Venugopal P.P.;Shilpa M.;Chakraborty D.
DOI 10.1002/prot.26077
6 9

Effective inhibition of mild steel corrosion by 6-bromo-(2,4-dimethoxyphenyl)methylidene]imidazo [1,2-a]pyridine-2-carbohydrazide in 0.5 M HCl: Insights from experimental and computational study

Open Access
Article
Journal of Molecular Structure. Year: 2021. Volume: 1232 .
Authors: Vranda Shenoy K.;Venugopal P.P.;Reena Kumari P.D.;Chakraborty D.
DOI 10.1016/j.molstruc.2021.130074
10 33

Structural and dynamical properties of water in surfactant-like peptide-based nanotubes: Effect of pore size, tube length and charge

Open Access
Article
Journal of Molecular Liquids. Year: 2021. Volume: 323 .
Authors: Dilip H.N.;Chakraborty D.
DOI 10.1016/j.molliq.2020.115033
6 10