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Hari Datt Pandey, Ph.D.
Hari Datt Pandey, Ph.D.
Assistant Professor of Chemistry/biochemistry, Allegheny College, Pennsylvania
Verified email at allegheny.edu
Title
Cited by
Cited by
Year
Energy transport across interfaces in biomolecular systems
DM Leitner, HD Pandey, KM Reid
The Journal of Physical Chemistry B 123 (45), 9507-9524, 2019
382019
Thermalization and thermal transport in molecules
HD Pandey, DM Leitner
The Journal of Physical Chemistry Letters 7 (24), 5062-5067, 2016
352016
Influence of thermalization on thermal conduction through molecular junctions: Computational study of PEG oligomers
HD Pandey, DM Leitner
The Journal of Chemical Physics 147 (8), 2017
342017
Thermodynamics of hydration water around an antifreeze protein: a molecular simulation study
HD Pandey, DM Leitner
The Journal of Physical Chemistry B 121 (41), 9498-9507, 2017
232017
Tuning molecular vibrational energy flow within an aromatic scaffold via anharmonic coupling
AJ Schmitz, HD Pandey, F Chalyavi, T Shi, EE Fenlon, SH Brewer, ...
The Journal of Physical Chemistry A 123 (49), 10571-10581, 2019
222019
Asymmetric energy flow in liquid alkylbenzenes: A computational study
DM Leitner, HD Pandey
The Journal of Chemical Physics 143 (14), 2015
222015
Quantum bottlenecks and unidirectional energy flow in molecules
DM Leitner, HD Pandey
Annalen der Physik 527 (9-10), 601-609, 2015
202015
Vibrational energy transport in molecules and the statistical properties of vibrational modes
HD Pandey, DM Leitner
Chemical Physics 482, 81-85, 2017
192017
Elastic and inelastic contributions to thermal transport between chemical groups and thermal rectification in molecules
KM Reid, HD Pandey, DM Leitner
The Journal of Physical Chemistry C 123 (10), 6256-6264, 2019
152019
Vibrational states and nitrile lifetimes of cyanophenylalanine isotopomers in solution
HD Pandey, DM Leitner
The Journal of Physical Chemistry A 122 (34), 6856-6863, 2018
132018
Small saccharides as a blanket around proteins: A computational study
HD Pandey, DM Leitner
The Journal of Physical Chemistry B 122 (29), 7277-7285, 2018
112018
Acoustic Signatures of Boiling Critical Heat Flux and Interfacial Instabilities
Y Sun, H Pandey, S Pierson, H Hu, K White, Y Xu, K Bellur
Bulletin of the American Physical Society, 2023
2023
Data Acquisition Using LabVIEW and MATLAB for Mechanical Engineering Laboratories
T Harris, S Pierson, H Pandey, H Hu
2023
Modeling ligand-CDK8/CycC unbinding free energy barriers for designing drugs with preferred binding kinetics
CE Chang, Z Tang, SH Chen, H Pandey
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019
2019
Milestone based computational approach to estimate energy barriers in the drug designing, and application to P38-MAP kinase-SB2 system
H Pandey, SH Chen, Z Tang, CE Chang
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019
2019
Structure-kinetics relationship study of CDK8 inhibitors with milestoning
SH Chen, Z Tang, H Pandey, CE Chang
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019
2019
Modeling ligand-CDK8/CycC unbinding free energy barriers for designing drugs with preferred binding kinetics
Chia-En Chang, Zhiye Tang, Si-Han Chen, Hari Datt Pandey
AMERICAN CHEMICAL SOCIETY, August, 25-29, 2019, 2019
2019
Structure-kinetics relationship study of CDK8 inhibitors with milestoning
Si-Han Chen, Zhiye Tang, Hari Datt Pandey, Chia-En Chang
AMERICAN CHEMICAL SOCIETY, August 25-29,2019,, 2019
2019
Milestone based computational approach to estimate energy barriers in the drug designing, and application to P38-MAP kinase-SB2 system
Hari D. Pandey , Si-Han Chen , Zhiye Tang, Chia-En Chang
AMERICAN CHEMICAL SOCIETY, August,25-29, 2019, 2019
2019
Estimating vibrational lifetime and boundary conductance
HD Pandey
Res. Rev. J Mat. Sci. 2018 6 (2321-6212), 29, 2018
2018
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