Energy transport across interfaces in biomolecular systems DM Leitner, HD Pandey, KM Reid The Journal of Physical Chemistry B 123 (45), 9507-9524, 2019 | 38 | 2019 |
Thermalization and thermal transport in molecules HD Pandey, DM Leitner The Journal of Physical Chemistry Letters 7 (24), 5062-5067, 2016 | 35 | 2016 |
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 | 34 | 2017 |
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 | 23 | 2017 |
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 | 22 | 2019 |
Asymmetric energy flow in liquid alkylbenzenes: A computational study DM Leitner, HD Pandey The Journal of Chemical Physics 143 (14), 2015 | 22 | 2015 |
Quantum bottlenecks and unidirectional energy flow in molecules DM Leitner, HD Pandey Annalen der Physik 527 (9-10), 601-609, 2015 | 20 | 2015 |
Vibrational energy transport in molecules and the statistical properties of vibrational modes HD Pandey, DM Leitner Chemical Physics 482, 81-85, 2017 | 19 | 2017 |
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 | 15 | 2019 |
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 | 13 | 2018 |
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 | 11 | 2018 |
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 |