Statistically Optimal Force Aggregation for Coarse-Graining Molecular
Dynamics

Statistically Optimal Force Aggregation for Coarse-Graining Molecular Dynamics

14 February 2023

Andreas Krämer

Aleksander E. P. Durumeric

Frank Noé

Papers citing "Statistically Optimal Force Aggregation for Coarse-Graining Molecular Dynamics"

4 / 4 papers shown

Title
DiAMoNDBack: Diffusion-denoising Autoregressive Model for Non-Deterministic Backmapping of Cα Protein Traces Michael S. Jones Kirill Shmilovich Andrew L. Ferguson DiffM 34 12 0 23 Jul 2023
Implicit Transfer Operator Learning: Multiple Time-Resolution Surrogates for Molecular Dynamics M. Schreiner Ole Winther Simon Olsson OOD AI4CE 41 13 0 29 May 2023
Contrastive Learning of Coarse-Grained Force Fields Xinqiang Ding Bin W. Zhang 33 21 0 22 May 2022
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 33 158 0 22 Jul 2020