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Frédéric Célerse
ORCID
Publication Activity (10 Years)
Years Active: 2020-2024
Publications (10 Years): 2
Top Topics
High Order
Complex Systems
Software Repositories
Emergent Behavior
Top Venues
CoRR
J. Chem. Inf. Model.
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Publications
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Frédéric Célerse
,
Matthew D. Wodrich
,
Sergi Vela
,
Simone Gallarati
,
Raimon Fabregat
,
Veronika Jurásková
,
Clémence Corminboeuf
From Organic Fragments to Photoswitchable Catalysts: The OFF-ON Structural Repository for Transferable Kernel-Based Potentials.
J. Chem. Inf. Model.
64 (4) (2024)
Olivier Adjoua
,
Louis Lagardère
,
Luc-Henri Jolly
,
Arnaud Durocher
,
Thibaut Very
,
Isabelle Dupays
,
Zhi Wang
,
Théo Jaffrelot Inizan
,
Frédéric Célerse
,
Pengyu Y. Ren
,
Jay W. Ponder
,
Jean-Philip Piquemal
Tinker-HP : Accelerating Molecular Dynamics Simulations of Large Complex Systems with Advanced Point Dipole Polarizable Force Fields using GPUs and Multi-GPUs systems.
CoRR
(2020)