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Updated: Aug 11, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
10:52

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics

Published on: April 12, 2019

QSAR modeling of large heterogeneous sets of molecules

J Devillers1

  • 1CTIS, Rillieux La Pape, France. j.devillers@ctis.fr

SAR and QSAR in Environmental Research
|January 30, 2002
PubMed

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