TorsionNet: A Reinforcement Learning Approach to Sequential Conformer Search

12 June 2020

Papers citing "TorsionNet: A Reinforcement Learning Approach to Sequential Conformer Search"

5 / 5 papers shown

Title
Implicit Transfer Operator Learning: Multiple Time-Resolution Surrogates for Molecular Dynamics M. Schreiner Ole Winther Simon Olsson OOD AI4CE 38 13 0 29 May 2023
Graph Representation Learning for Interactive Biomolecule Systems Xinye Xiong Bingxin Zhou Yu Guang Wang AI4CE GNN 22 0 0 05 Apr 2023
GeoDiff: a Geometric Diffusion Model for Molecular Conformation Generation Minkai Xu Lantao Yu Yang Song Chence Shi Stefano Ermon Jian Tang BDL DiffM 9 494 0 06 Mar 2022
Curriculum Learning for Reinforcement Learning Domains: A Framework and Survey Sanmit Narvekar Bei Peng Matteo Leonetti Jivko Sinapov Matthew E. Taylor Peter Stone ODL 132 455 0 10 Mar 2020
Graph Convolutional Policy Network for Goal-Directed Molecular Graph Generation Jiaxuan You Bowen Liu Rex Ying Vijay S. Pande J. Leskovec GNN 189 884 0 07 Jun 2018