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Pradeep Kumar Gurunathan
AD Scientific Index 2024
Natural Sciences / Chemical Sciences
Pacific Northwest National Laboratory - Richland / United States
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Pradeep Kumar Gurunathan's MOST POPULAR ARTICLES
1-)
Extension of the effective fragment potential method to macromoleculesPK Gurunathan, A Acharya, D Ghosh, D Kosenkov, I Kaliman, Y Shao, ...The Journal of Physical Chemistry B 120 (27), 6562-6574, 2016952016
2-)
Polarizable embedding for simulating redox potentials of biomoleculesRN Tazhigulov, PK Gurunathan, Y Kim, LV Slipchenko, KB BravayaPhysical Chemistry Chemical Physics 21 (22), 11642-11650, 2019282019
3-)
Effective fragment potential method: Past, present, and futureLV Slipchenko, PK GurunathanFragmentation: Toward Accurate Calculations on Complex Molecular Systems …, 2017232017
4-)
Excited states of OH-(H2O) n clusters for n= 1–4: An ab initio studyGJ Hoffman, PK Gurunathan, JS Francisco, LV SlipchenkoThe Journal of chemical physics 141 (10), 2014212014
5-)
Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acidVG Saraswatula, MA Bhat, PK Gurunathan, BK SahaCrystEngComm 16 (22), 4715-4721, 2014122014
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