Top-down machine learning of coarse-grained protein force-fields

20 June 2023

Papers citing "Top-down machine learning of coarse-grained protein force-fields"

4 / 4 papers shown

Title
AMARO: All Heavy-Atom Transferable Neural Network Potentials of Protein Thermodynamics Antonio Mirarchi Raúl P. Peláez Guillem Simeon Gianni de Fabritiis 23 3 0 26 Sep 2024
chemtrain: Learning Deep Potential Models via Automatic Differentiation and Statistical Physics Paul Fuchs Stephan Thaler Sebastien Röcken J. Zavadlav DiffM 72 6 0 28 Aug 2024
Accurate machine learning force fields via experimental and simulation data fusion Sebastien Röcken J. Zavadlav AI4CE 29 12 0 17 Aug 2023
Coarse Graining Molecular Dynamics with Graph Neural Networks B. Husic N. Charron Dominik Lemm Jiang Wang Adria Pérez ... Yaoyi Chen Simon Olsson Gianni de Fabritiis Frank Noé C. Clementi AI4CE 35 158 0 22 Jul 2020