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Environmental Science and Pollution Research International
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June 30, 2023
Towards sustainable development: research on the green growth effect of digital agriculture in China
Yumei Lin, Chenghan Li
The Journal of Physical Chemistry. B
|
September 14, 2021
Accurate and Transferable Reactive Molecular Dynamics Models from Constrained Density Functional Theory
Chenghan Li, Gregory A Voth
Proceedings of the National Academy of Sciences of the United States of America
|
February 5, 2026
Predictive free energy simulations through hierarchical distillation of quantum Hamiltonians
Chenghan Li, Garnet Kin-Lic Chan
Journal of Chemical Theory and Computation
|
January 4, 2022
Using Machine Learning to Greatly Accelerate Path Integral <i>Ab Initio</i> Molecular Dynamics
Chenghan Li, Gregory A Voth
Journal of Chemical Theory and Computation
|
September 1, 2021
Using Constrained Density Functional Theory to Track Proton Transfers and to Sample Their Associated Free Energy Surface
Chenghan Li, Gregory A Voth
Proceedings of the National Academy of Sciences of the United States of America
|
December 3, 2021
A quantitative paradigm for water-assisted proton transport through proteins and other confined spaces
Chenghan Li, Gregory A Voth
The Journal of Physical Chemistry. B
|
December 2, 2022
Generalized Transition State Theory Treatment of Water-Assisted Proton Transport Processes in Proteins
Yu Liu, Chenghan Li, Gregory A Voth
Journal of Chemical Theory and Computation
|
January 15, 2025
Accurate QM/MM Molecular Dynamics for Periodic Systems in GPU4PySCF with Applications to Enzyme Catalysis
Chenghan Li, Garnet Kin-Lic Chan
The Journal of Physical Chemistry. B
|
June 10, 2020
Understanding and Tracking the Excess Proton in Ab Initio Simulations; Insights from IR Spectra
Chenghan Li, Jessica M J Swanson
Journal of the American Chemical Society
|
November 1, 2021
Resolving the Structural Debate for the Hydrated Excess Proton in Water
Paul B Calio, Chenghan Li, Gregory A Voth
Page
of 5
Search research articles
Search
Showing results (1-10 of 43) with videos related to
Sort By:
Page
of 5
Environmental Science and Pollution Research International
|
June 30, 2023
Towards sustainable development: research on the green growth effect of digital agriculture in China
Yumei Lin, Chenghan Li
The Journal of Physical Chemistry. B
|
September 14, 2021
Accurate and Transferable Reactive Molecular Dynamics Models from Constrained Density Functional Theory
Chenghan Li, Gregory A Voth
Proceedings of the National Academy of Sciences of the United States of America
|
February 5, 2026
Predictive free energy simulations through hierarchical distillation of quantum Hamiltonians
Chenghan Li, Garnet Kin-Lic Chan
Journal of Chemical Theory and Computation
|
January 4, 2022
Using Machine Learning to Greatly Accelerate Path Integral <i>Ab Initio</i> Molecular Dynamics
Chenghan Li, Gregory A Voth
Journal of Chemical Theory and Computation
|
September 1, 2021
Using Constrained Density Functional Theory to Track Proton Transfers and to Sample Their Associated Free Energy Surface
Chenghan Li, Gregory A Voth
Proceedings of the National Academy of Sciences of the United States of America
|
December 3, 2021
A quantitative paradigm for water-assisted proton transport through proteins and other confined spaces
Chenghan Li, Gregory A Voth
The Journal of Physical Chemistry. B
|
December 2, 2022
Generalized Transition State Theory Treatment of Water-Assisted Proton Transport Processes in Proteins
Yu Liu, Chenghan Li, Gregory A Voth
Journal of Chemical Theory and Computation
|
January 15, 2025
Accurate QM/MM Molecular Dynamics for Periodic Systems in GPU4PySCF with Applications to Enzyme Catalysis
Chenghan Li, Garnet Kin-Lic Chan
The Journal of Physical Chemistry. B
|
June 10, 2020
Understanding and Tracking the Excess Proton in Ab Initio Simulations; Insights from IR Spectra
Chenghan Li, Jessica M J Swanson
Journal of the American Chemical Society
|
November 1, 2021
Resolving the Structural Debate for the Hydrated Excess Proton in Water
Paul B Calio, Chenghan Li, Gregory A Voth
Page
of 5