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The Journal of Physical Chemistry. B
|
October 21, 2022
Improving Condensed-Phase Water Dynamics with Explicit Nuclear Quantum Effects: The Polarizable Q-AMOEBA Force Field
Nastasia Mauger, Thomas Plé, Louis Lagardère, et al.
The Journal of Physical Chemistry Letters
|
June 2, 2025
The Q-AMOEBA (CF) Polarizable Potential
Nastasia Mauger, Thomas Plé, Louis Lagardère, et al.
The Journal of Physical Chemistry Letters
|
August 24, 2021
Nuclear Quantum Effects in Liquid Water at Near Classical Computational Cost Using the Adaptive Quantum Thermal Bath
Nastasia Mauger, Thomas Plé, Louis Lagardère, et al.
Journal of Chemical Theory and Computation
|
March 1, 2023
Routine Molecular Dynamics Simulations Including Nuclear Quantum Effects: From Force Fields to Machine Learning Potentials
Thomas Plé, Nastasia Mauger, Olivier Adjoua, et al.
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Search research articles
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Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
The Journal of Physical Chemistry. B
|
October 21, 2022
Improving Condensed-Phase Water Dynamics with Explicit Nuclear Quantum Effects: The Polarizable Q-AMOEBA Force Field
Nastasia Mauger, Thomas Plé, Louis Lagardère, et al.
The Journal of Physical Chemistry Letters
|
June 2, 2025
The Q-AMOEBA (CF) Polarizable Potential
Nastasia Mauger, Thomas Plé, Louis Lagardère, et al.
The Journal of Physical Chemistry Letters
|
August 24, 2021
Nuclear Quantum Effects in Liquid Water at Near Classical Computational Cost Using the Adaptive Quantum Thermal Bath
Nastasia Mauger, Thomas Plé, Louis Lagardère, et al.
Journal of Chemical Theory and Computation
|
March 1, 2023
Routine Molecular Dynamics Simulations Including Nuclear Quantum Effects: From Force Fields to Machine Learning Potentials
Thomas Plé, Nastasia Mauger, Olivier Adjoua, et al.
Page
of 1