Articoli con mandati relativi all'accesso pubblico - Atanu AcharyaUlteriori informazioni
Non concessi: 1
Phenothiazine Radical Cation Excited States as Super-oxidants for Energy-Demanding Reactions
JA Christensen, BT Phelan, S Chaudhuri, A Acharya, VS Batista, ...
Journal of the American Chemical Society 140 (15), 5290-5299, 2018
Mandati: US Department of Energy
Autori responsabili: MR Wasielewski
Disponibili pubblicamente: 25
Photoinduced Chemistry in Fluorescent Proteins: Curse or Blessing?
A Acharya, AM Bogdanov, BL Grigorenko, KB Bravaya, AV Nemukhin, ...
Chemical Reviews 117 (2), 758-795, 2017
Mandati: US National Science Foundation
Supercomputer-based ensemble docking drug discovery pipeline with application to COVID-19
A Acharya, R Agarwal, MB Baker, J Baudry, D Bhowmik, S Boehm, ...
Journal of chemical information and modeling 60 (12), 5832-5852, 2020
Mandati: US National Science Foundation, US Department of Energy, US National …
Electric field stimulates production of highly conductive microbial OmcZ nanowires
SE Yalcin, JP O’Brien, Y Gu, K Reiss, SM Yi, R Jain, V Srikanth, PJ Dahl, ...
Nature chemical biology 16 (10), 1136-1142, 2020
Mandati: US National Science Foundation, US Department of Energy, US Department of …
Extension of the effective fragment potential method to macromolecules
PK Gurunathan, A Acharya, D Ghosh, D Kosenkov, I Kaliman, Y Shao, ...
The Journal of Physical Chemistry B 120 (27), 6562-6574, 2016
Mandati: US National Science Foundation, Council of Scientific and Industrial …
Allosteric Motions of the CRISPR-Cas9 HNH Nuclease Probed by NMR and Molecular Dynamics
KW East, JC Newton, UN Morzan, Y Narkhede, A Acharya, E Skeens, ...
Journal of the American Chemical Society, 2020
Mandati: US National Science Foundation, US National Institutes of Health
Turning On and Off Photoinduced Electron Transfer in Fluorescent Proteins by π-Stacking, Halide Binding, and Tyr145 Mutations
AM Bogdanov, A Acharya, AV Titelmayer, AV Mamontova, KB Bravaya, ...
Journal of American Chemical Society 138 (14), 4807–4817, 2016
Mandati: US National Science Foundation
Inhibitor binding influences the protonation states of histidines in SARS-CoV-2 main protease
A Pavlova, DL Lynch, I Daidone, L Zanetti-Polzi, MD Smith, C Chipot, ...
Chemical Science 12 (4), 1513-1527, 2021
Mandati: US National Science Foundation, US Department of Energy, US National …
Machine Learning Reveals the Critical Interactions for SARS-CoV-2 Spike Protein Binding to ACE2
A Pavlova, Z Zhang, A Acharya, DL Lynch, YT Pang, Z Mou, JM Parks, ...
The Journal of Physical Chemistry Letters 12, 5494-5502, 2021
Mandati: US National Science Foundation, US Department of Energy, Agence Nationale de …
SARS-CoV-2 spike opening dynamics and energetics reveal the individual roles of glycans and their collective impact
YT Pang, A Acharya, DL Lynch, A Pavlova, JC Gumbart
Communications biology 5 (1), 1-11, 2022
Mandati: US National Science Foundation
A 300-fold conductivity increase in microbial cytochrome nanowires due to temperature-induced restructuring of hydrogen bonding networks
PJ Dahl, SM Yi, Y Gu, A Acharya, C Shipps, J Neu, JP O’Brien, ...
Science Advances 8 (19), eabm7193, 2022
Mandati: US National Science Foundation, US Department of Energy, US Department of …
Can TDDFT Describe Excited Electronic States of Naphthol Photoacids? A Closer Look with EOM-CCSD
A Acharya, S Chaudhuri, VS Batista
Journal of Chemical Theory and Computation 14 (2), 867-876, 2018
Mandati: US National Science Foundation, US Department of Energy
The Effect of (-)-epigallocatechin-3-gallate on the Amyloid-β Secondary Structure
A Acharya, J Stockmann, L Beyer, T Rudack, A Nabers, JC Gumbart, ...
Biophysical Journal 119, 2020
Mandati: US National Science Foundation, US Department of Energy, US National …
ACE2 glycans preferentially interact with SARS-CoV-2 over SARS-CoV
A Acharya, DL Lynch, A Pavlova, YT Pang, JC Gumbart
Chemical Communications, 2021
Mandati: US National Science Foundation
Proton transfer activity of the reconstituted Mycobacterium tuberculosis MmpL3 is modulated by substrate mimics and inhibitors
CM Stevens, SO Babii, AN Pandya, W Li, Y Li, J Mehla, R Scott, P Hegde, ...
Proceedings of the National Academy of Sciences 119 (30), e2113963119, 2022
Mandati: US National Science Foundation, US National Institutes of Health
Restoring and Enhancing the Potency of Existing Antibiotics against Drug-Resistant Gram-Negative Bacteria through the Development of Potent Small-Molecule Adjuvants
B Yu, M Roy Choudhury, X Yang, SL Benoit, E Womack, ...
ACS Infectious Diseases 8 (8), 1491-1508, 2022
Mandati: US National Science Foundation, US National Institutes of Health
Influence of the First Chromophore-Forming Residue on Photobleaching and Oxidative Photoconversion of EGFP and EYFP
T Sen, AV Mamontova, AV Titelmayer, AM Shakhov, AA Astafiev, ...
International Journal of Molecular Sciences 20 (20), 5229, 2019
Mandati: US National Science Foundation
Gatekeeping Ketosynthases Dictate Initiation of Assembly Line Biosynthesis of Pyrrolic Polyketides
D Yi, A Acharya, JC Gumbart, WR Gutekunst, V Agarwal
Journal of the American Chemical Society 143 (20), 7617-7622, 2021
Mandati: US National Science Foundation
Regioselective Ultrafast Photoinduced Electron Transfer from Naphthols to Halocarbon Solvents
S Chaudhuri, A Acharya, E Nibbering, VS Batista
J. Phys. Chem. Lett. 10, 2657–2662, 2019
Mandati: US National Science Foundation, US Department of Energy, US Department of …
Insights into substrate transport and water permeation in the mycobacterial transporter MmpL3
Y Li, A Acharya, L Yang, J Liu, E Tajkhorshid, HI Zgurskaya, M Jackson, ...
Biophysical journal 122 (11), 2342-2352, 2023
Mandati: US National Science Foundation, US National Institutes of Health
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