フォロー
Abhishek Mukhopadhyay
Abhishek Mukhopadhyay
Protein Sciences, Gandeeva Therapeutics
確認したメール アドレス: gandeeva.com
タイトル
引用先
引用先
Charge hydration asymmetry: The basic principle and how to use it to test and improve water models
A Mukhopadhyay, AT Fenley, IS Tolokh, AV Onufriev
The journal of physical chemistry B 116 (32), 9776-9783, 2012
832012
Statistical mechanics model for the dynamics of collective epigenetic histone modification
H Zhang, XJ Tian, A Mukhopadhyay, KS Kim, J Xing
Physical review letters 112 (6), 068101, 2014
562014
Introducing charge hydration asymmetry into the generalized Born model
A Mukhopadhyay, BH Aguilar, IS Tolokh, AV Onufriev
Journal of Chemical Theory and Computation 10 (4), 1788-1794, 2014
382014
An anti-HER2 biparatopic antibody that induces unique HER2 clustering and complement-dependent cytotoxicity
NE Weisser, M Sanches, E Escobar-Cabrera, J O’Toole, E Whalen, ...
Nature Communications 14 (1), 1394, 2023
282023
Opinion formation on adaptive networks with intensive average degree
B Schmittmann, A Mukhopadhyay
physical Review E 82 (6), 066104, 2010
182010
Strongly bent double-stranded DNA: reconciling theory and experiment
A Drozdetski, A Mukhopadhyay, AV Onufriev
Frontiers in Physics 7, 195, 2019
162019
Accurate evaluation of charge asymmetry in aqueous solvation
A Mukhopadhyay, IS Tolokh, AV Onufriev
The Journal of Physical Chemistry B 119 (20), 6092-6100, 2015
162015
Multidimensional global optimization and robustness analysis in the context of protein–ligand binding
N Forouzesh, A Mukhopadhyay, LT Watson, AV Onufriev
Journal of chemical theory and computation 16 (7), 4669-4684, 2020
122020
ZymePackNet: rotamer-sampling free graph neural network method for protein sidechain prediction
A Mukhopadhyay, A Kadan, B McMaster, JL McWhirter, SB Dixit
bioRxiv, 2023.05. 05.539648, 2023
22023
Systematic reverse engineering of network topologies: A case study of resettable bistable cellular responses
D Mondal, E Dougherty, A Mukhopadhyay, A Carbo, G Yao, J Xing
PloS one 9 (8), e105833, 2014
22014
A numerical procedure for model reduction using the generalized Langevin equation formalism
A Mukhopadhyay, J Xing
arXiv preprint arXiv:1304.4908, 2013
22013
SYSTEMS AND METHODS FOR POLYMER SIDE-CHAIN ​​CONFORMATION PREDICTION
A MUKHOPADHYAY, SB DIXIT, A GIL LEY, JL MCWHIRTER, ...
US Patent WO/2023/070,229, 2023
2023
SYSTEMS AND METHODS FOR POLYMER SEQUENCE PREDICTION
JL MCWHIRTER, G LAKATOS, SB DIXIT, A MUKHOPADHYAY, ...
US Patent WO/2023/070,230, 2023
2023
Automated Protein Affinity Optimization using a 1D-CNN Deep Learning Model
JL McWhirter, A Mukhopadhyay, P Farber, G Lakatos, S Dixit
bioRxiv, 2023.04. 12.536512, 2023
2023
HETERODIMERIC FC VARIANTS SELECTIVE FOR FC GAMMA RIIB
E Escobar-Cabrera, G Lakatos, LG Presta, G Desjardins, ...
US Patent WO/2021/232,162, 2021
2021
Building accurate and fast implicit solvation models
I Tolokh, A Mukhopadhyay, A Onufriev
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019
2019
Multidimensional optimization of the dielectric boundary for protein-ligand binding computations in implicit solvent
N Forouzesh, A Mukhopadhyay, L Watson, A Onufriev
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019
2019
Investigating the effect of charge hydration asymmetry and incorporating it in continuum solvation framework
A Mukhopadhyay
Virginia Polytechnic Institute and State University, 2015
2015
Introducing charge hydration asymmetry into the continuum solvation framework
A Mukhopadhyay, BH Aguilar, IS Tolokh, AV Onufriev
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 248, 2014
2014
Strongly Bent DNA: Reconciling Theory and Experiment
A Drozdetski, A Mukhopadhyay, A Onufriev
Biophysical Journal 106 (2), 280a, 2014
2014
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論文 1–20