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Vivek S. Bharadwaj
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Advances in multiscale modeling of lignocellulosic biomass
PN Ciesielski, MB Pecha, AM Lattanzi, VS Bharadwaj, MF Crowley, L Bu, ...
ACS Sustainable Chemistry & Engineering 8 (9), 3512-3531, 2020
1022020
Structural, mutagenic and in silico studies of xyloglucan fucosylation in Arabidopsis thaliana suggest a water‐mediated mechanism
BR Urbanowicz, VS Bharadwaj, M Alahuhta, MJ Peña, VV Lunin, ...
The Plant Journal 91 (6), 931-949, 2017
652017
Nanomechanics of cellulose deformation reveal molecular defects that facilitate natural deconstruction
PN Ciesielski, R Wagner, VS Bharadwaj, J Killgore, A Mittal, GT Beckham, ...
Proceedings of the National Academy of Sciences 116 (20), 9825-9830, 2019
562019
Molecular Mechanism of Polysaccharide Acetylation by the Arabidopsis Xylan O-acetyltransferase XOAT1
VV Lunin, HT Wang, VS Bharadwaj, M Alahuhta, MJ Peña, JY Yang, ...
The Plant Cell 32 (7), 2367-2382, 2020
422020
Advancing catalytic fast pyrolysis through integrated multiscale modeling and experimentation: Challenges, progress, and perspectives
PN Ciesielski, MB Pecha, VS Bharadwaj, C Mukarakate, GJ Leong, ...
Wiley Interdisciplinary Reviews: Energy and Environment 7 (4), e297, 2018
382018
Beyond the effectiveness factor: Multi-step reactions with intraparticle diffusion limitations
AM Lattanzi, MB Pecha, VS Bharadwaj, PN Ciesielski
Chemical Engineering Journal 380, 122507, 2020
362020
Insights into the glycyl radical enzyme active site of benzylsuccinate synthase: a computational study
VS Bharadwaj, AM Dean, CM Maupin
Journal of the American Chemical Society 135 (33), 12279-12288, 2013
332013
Impact of Water-Dilution on the Solvation Properties of the Ionic Liquid 1-Methyltriethoxy-3-ethylimidazolium Acetate for Model Biomass Molecules
TC Schutt, GA Hegde, VS Bharadwaj, AJ Johns, CM Maupin
The Journal of Physical Chemistry B 121 (4), 843-853, 2017
292017
Understanding extreme fast charge limitations in carbonate mixtures
A Mallarapu, VS Bharadwaj, S Santhanagopalan
Journal of Materials Chemistry A 9 (8), 4858-4869, 2021
272021
In silico insights into the solvation characteristics of the ionic liquid 1-methyltriethoxy-3-ethylimidazolium acetate for cellulosic biomass
TC Schutt, VS Bharadwaj, GA Hegde, AJ Johns, CM Maupin
Physical Chemistry Chemical Physics 18 (34), 23715-23726, 2016
242016
Acetylcholine Promotes Binding of α‐Conotoxin MII at α3β2 Nicotinic Acetylcholine Receptors
SV Sambasivarao, J Roberts, VS Bharadwaj, JG Slingsby, C Rohleder, ...
Chembiochem 15 (3), 413-424, 2014
242014
Locating methyl-etherified and methyl-esterified uronic acids in the plant cell wall pectic polysaccharide rhamnogalacturonan II
MA O’Neill, I Black, B Urbanowicz, V Bharadwaj, M Crowley, S Koj, ...
SLAS TECHNOLOGY: Translating Life Sciences Innovation 25 (4), 329-344, 2020
232020
Elucidating the conformational energetics of glucose and cellobiose in ionic liquids
VS Bharadwaj, TC Schutt, TC Ashurst, CM Maupin
Physical Chemistry Chemical Physics 17 (16), 10668-10678, 2015
232015
The hydrolysis mechanism of a GH45 cellulase and its potential relation to lytic transglycosylase and expansin function
VS Bharadwaj, BC Knott, J Ståhlberg, GT Beckham, MF Crowley
Journal of Biological Chemistry 295 (14), 4477-4487, 2020
212020
Selective One-Dimensional 13C–13C Spin-Diffusion Solid-State Nuclear Magnetic Resonance Methods to Probe Spatial Arrangements in Biopolymers Including …
B Addison, D Stengel, VS Bharadwaj, RM Happs, C Doeppke, T Wang, ...
The Journal of Physical Chemistry B 124 (44), 9870-9883, 2020
202020
Impact of water dilution and cation tail length on ionic liquid characteristics: Interplay between polar and non-polar interactions
GA Hegde, VS Bharadwaj, CL Kinsinger, TC Schutt, NR Pisierra, ...
The Journal of Chemical Physics 145 (6), 2016
202016
Molecular Simulations of Fatty‐Acid Methyl Esters and Representative Biodiesel Mixtures
VS Bharadwaj, NM Eagan, NM Wang, MW Liberatore, CM Maupin
ChemPhysChem 16 (13), 2810-2817, 2015
192015
Multi-scale simulation of reaction, transport and deactivation in a SBA-16 supported catalyst for the conversion of ethanol to butadiene
VS Bharadwaj, MB Pecha, L Bu, VL Dagle, RA Dagle, PN Ciesielski
Catalysis Today, 2019
182019
Unravelling the impact of hydrocarbon structure on the fumarate addition mechanism–a gas-phase ab initio study
VS Bharadwaj, S Vyas, SM Villano, CM Maupin, AM Dean
Physical Chemistry Chemical Physics 17 (6), 4054-4066, 2015
172015
Different behaviors of a substrate in P450 decarboxylase and hydroxylase reveal reactivity-enabling actors
VS Bharadwaj, S Kim, MT Guarnieri, MF Crowley
Scientific Reports 8 (1), 12826, 2018
142018
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