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The Journal of Physical Chemistry. B|August 6, 2026
Tutorial for Atomistic and Coarse-Grained Simulations of Membrane-Nanoplastic Interactions Using GROMACSSasthi C Mandal, Atanu Acharya
Journal of Chemical Information and Modeling|April 25, 2025
Impact of Native Environment in Multiheme-Cytochrome Chains of the MtrCAB ComplexSasthi C Mandal, Ronit Sarangi, Atanu Acharya
ACS Applied Bio Materials|March 22, 2023
Many Roles of Carbohydrates: A Computational Spotlight on the Coronavirus S Protein BindingSuman Maity, Atanu Acharya
Biorxiv : the Preprint Server for Biology|March 23, 2026
Identification of Key Residues in Allosteric Signaling of Photoactivated Adenylyl CyclaseSuman Maity, Atanu Acharya
The Journal of Physical Chemistry. B|July 14, 2025
Effects of Conformational Sampling on Computing Redox Properties Using Linear Response ApproachSuman Maity, Ronit Sarangi, Atanu Acharya
Journal of Chemical Theory and Computation|July 24, 2024
Machine Learning Approach to Vertical Energy Gap in Redox ProcessesRonit Sarangi, Suman Maity, Atanu Acharya
Journal of Chemical Theory and Computation|January 4, 2018
Can TDDFT Describe Excited Electronic States of Naphthol Photoacids? A Closer Look with EOM-CCSDAtanu Acharya, Subhajyoti Chaudhuri, Victor S Batista
The Journal of Physical Chemistry. B|September 18, 2012
Toward understanding the redox properties of model chromophores from the green fluorescent protein family: an interplay between conjugation, resonance stabilization, and solvent effectsDebashree Ghosh, Atanu Acharya, Subodh C Tiwari, et al.
The Journal of Physical Chemistry Letters|May 4, 2019
Regioselective Ultrafast Photoinduced Electron Transfer from Naphthols to Halocarbon SolventsSubhajyoti Chaudhuri, Atanu Acharya, Erik T J Nibbering, et al.
The Journal of Physical Chemistry Letters|May 14, 2024
Variable Non-Gaussian Transport of Nanoplastic on Supported Lipid Bilayers in Saline ConditionsDiyali Sil, Edin Osmanbasic, Sasthi Charan Mandal, et al.
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