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Gabriel Stoltz

institut polytechnique de paris

24H指数
178论文数
2.6K被引数
收录论文 25
发表时间
Machine learning assisted canonical sampling (Mlacs)机器学习辅助规范采样 (Mlacs)
err2025-07-17
err0
PREAI
errAloïs Castellano; Romuald Béjaud; Pauline Richard; Olivier Nadeau; Clément Duval; Grégory Geneste; Gabriel Antonius; Johann Bouchet; Antoine Levitt; Gabriel Stoltz; François Bottin
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Autoencoders for dimensionality reduction in molecular dynamics: Collective variable dimension, biasing, and transition states
err2023-07-11
err5
errOAAI
errBelkacemi, Zineb; Bianciotto, Marc; Minoux, Herve; Lelievre, Tony; Stoltz, Gabriel; Gkeka, Paraskevi
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Computing Surface Reaction Rates by Adaptive Multilevel Splitting Combined with Machine Learning and Ab Initio Molecular Dynamics
err2023-06-05
err5
errOAAI
errPigeon, Thomas; Stoltz, Gabriel; Corral-Valero, Manuel; Anciaux-Sedrakian, Ani; Moreaud, Maxime; Lelievre, Tony; Raybaud, Pascal
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Ab initio canonical sampling based on variational inference
err2022-10-20
err7
errOAAI
errCastellano, Alois; Bottin, Francois; Bouchet, Johann; Levitt, Antoine; Stoltz, Gabriel
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Chasing Collective Variables Using Autoencoders and Biased Trajectories
err2021-12-29
err53
errOAAI
errBelkacemi, Zineb; Gkeka, Paraskevi; Lelievre, Tony; Stoltz, Gabriel
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Machine Learning Force Fields and Coarse-Grained Variables in Molecular Dynamics: Application to Materials and Biological Systems
err2020-06-19
err131
errOAAI
errGkeka, Paraskevi; Stoltz, Gabriel; Farimani, Amir Barati; Belkacemi, Zineb; Ceriotti, Michele; Chodera, John D.; Dinner, Aaron R.; Ferguson, Andrew L.; Maillet, Jean-Bernard; Minoux, Herve; Peter, Christine; Pietrucci, Fabio; Silveira, Ana; Tkatchenko, Alexandre; Trstanova, Zofia; Wiewiora, Rafal; Lelievre, Tony
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Cluster dynamics modelling of materials: A new hybrid deterministic/stochastic coupling approach
err2017-12-01
err17
errOAAI
errTerrier, Pierre; Athenes, Manuel; Jourdan, Thomas; Adjanor, Gilles; Stoltz, Gabriel
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Robust determination of maximally localized Wannier functions
err2017-02-06
err26
errOAAI
errCances, Eric; Levitt, Antoine; Panati, Gianluca; Stoltz, Gabriel
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Coupling a reactive potential with a harmonic approximation for atomistic simulations of material failure
err2016-06-01
err1
errOAAI
errTejada, Ignacio G.; Brochard, Laurent; Lelievre, Tony; Stoltz, Gabriel; Legoll, Frederic; Cances, Eric
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New parallelizable schemes for integrating the Dissipative Particle Dynamics with Energy conservation
err2016-01-12
err11
errOAAI
errHomman, Ahmed-Amine; Maillet, Jean-Bernard; Roussel, Julien; Stoltz, Gabriel
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Free energy calculations from adaptive molecular dynamics simulations with adiabatic reweighting
err2014-03-27
err2
errOAAI
errCao, Lingling; Stoltz, Gabriel; Lelievre, Tony; Marinica, Mihai-Cosmin; Athenes, Manuel
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Local density dependent potential for compressible mesoparticles
err2014-03-20
err7
errOAAI
errFaure, Gerome; Maillet, Jean-Bernard; Stoltz, Gabriel
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Free energy calculations from adaptive molecular dynamics simulations with adiabatic reweighting
err2014-03-11
err15
errOAAI
errCao, Lingling; Stoltz, Gabriel; Lelievre, Tony; Marinica, Mihai-Cosmin; Athenes, Manuel
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