Ministry of Education
Divya Nayar
VIDWAN ID: 158377

Dr Divya Nayar

Female Doctor of Philosophy
Assistant Professor (Grade-I)
Indian Institute of Technology, Kharagpur
West Bengal
Expertise: Applied Chemistry
ORCID 0000-0001-8569-7633 Scopus 53164511700 Google Scholar yEu2HnMAAAAJ
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34 Publications
0 Projects
842 Scopus Citations
856 CrossRef
8 Years 4 Months Total Experience
Publications
34 Total
Articles
33
Proceedings
1
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Scopus Scopus
842 Citations
15 h-index
CrossRef CrossRef
856 Citations
16 h-index
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Personal Details

Doctor of Philosophy
N/A
Assistant Professor (Grade-I)
May 2018 – Present
Indian Institute of Technology, Kharagpur
Chemical Sciences
Applied Chemistry

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Scholarly Publications

PLAS-20k: Extended Dataset of Protein-Ligand Affinities from MD Simulations for Machine Learning Applications

Open Access
Data Paper
Scientific Data. Year: 2024. Volume: 11 , Issue: 1 .
Authors: Divya B. Korlepara; Vasavi C. S.; Rakesh Srivastava; Pradeep Kumar Pal; Saalim H. Raza; Vishal Kumar; Shivam Pandit; Aathira G. Nair; Sanjana Pandey; Shubham Sharma; Shruti Jeurkar; Kavita Thakran; Reena Jaglan; Shivangi Verma; Indhu Ramachandran; Prathit Chatterjee; Divya Nayar; U. Deva Priyakumar
DOI 10.1038/s41597-023-02872-y Crossref Crossref: 21 Scopus Scopus: 21

Correction to: PLAS-20k: Extended Dataset of Protein-Ligand Affinities from MD Simulations for Machine Learning Applications (Scientific Data, (2024), 11, 1, (180), 10.1038/s41597-023-02872-y)

Open Access
Erratum
Scientific Data. Year: 2024. Volume: 11 , Issue: 1 .
Authors: Divya B. Korlepara; C. S. Vasavi; Rakesh Srivastava; Pradeep Kumar Pal; Saalim H. Raza; Vishal Kumar; Shivam Pandit; Aathira G. Nair; Sanjana Pandey; Shubham Sharma; Shruti Jeurkar; Kavita Thakran; Reena Jaglan; Shivangi Verma; Indhu Ramachandran; Prathit Chatterjee; Divya Nayar; U. Deva Priyakumar
DOI 10.1038/s41597-024-03585-6 Crossref Crossref: 1 Scopus Scopus: 1

Crowding effects on biomolecular processes: Computational advances and challenges

Review
Current Opinion in Structural Biology. Year: 2026. Volume: 101 .
Authors: Shivnandi; Divya Nayar
DOI 10.1016/j.sbi.2026.103345

An interplay of excluded-volume and polymer–(co)solvent attractive interactions regulates polymer collapse in mixed solvents

Open Access
Journal Article
The Journal of Chemical Physics. Year: 2021. Volume: 154 , Issue: 13 , Pages: 134903 .
Authors: Swaminath Bharadwaj; Divya Nayar; Cahit Dalgicdir; Nico F. A. van der Vegt
DOI 10.1063/5.0046746 Crossref Crossref: 29 Scopus Scopus: 30

Crowding effects on water-mediated hydrophobic interactions

Journal Article
The Journal of Chemical Physics. Year: 2021. Volume: 155 , Issue: 2 , Pages: 024903 .
Authors: Rahul Sahu; Divya Nayar
DOI 10.1063/5.0054410 Crossref Crossref: 7 Scopus Scopus: 10

A cosolvent surfactant mechanism affects polymer collapse in miscible good solvents

Open Access
Journal Article
Communications Chemistry. Year: 2020. Volume: 3 , Issue: 1 , Pages: 165 .
Authors: Swaminath Bharadwaj; Divya Nayar; Cahit Dalgicdir; Nico F. A. van der Vegt
DOI 10.1038/s42004-020-00405-x Crossref Crossref: 38 Scopus Scopus: 37

Small crowder interactions can drive hydrophobic polymer collapse as well as unfolding

Journal Article
Physical Chemistry Chemical Physics. Year: 2020. Volume: 22 , Issue: 32 , Pages: 18091-18101 .
Authors: Divya Nayar
DOI 10.1039/D0CP02402C Crossref Crossref: 14 Scopus Scopus: 14

Convergence of Kirkwood-Buff Integrals of Ideal and Nonideal Aqueous Solutions Using Molecular Dynamics Simulations

Journal Article
The Journal of Physical Chemistry B. Year: 2018. Volume: 122 , Issue: 21 , Pages: 5515-5526 .
Authors: Milzetti, J.; Nayar, D.; Van Der Vegt, N.F.A.
DOI 10.1021/acs.jpcb.7b11831 Crossref Crossref: 76 Scopus Scopus: 74
Showing 1 to 8 of 34 publications