Improving Molecular Modeling with Geometric GNNs: an Empirical Study

11 July 2024

Papers citing "Improving Molecular Modeling with Geometric GNNs: an Empirical Study"

5 / 5 papers shown

Title
Ewald-based Long-Range Message Passing for Molecular Graphs Arthur Kosmala Johannes Gasteiger Nicholas Gao Stephan Günnemann 64 25 0 08 Mar 2023
Frame Averaging for Invariant and Equivariant Network Design Omri Puny Matan Atzmon Heli Ben-Hamu Ishan Misra Aditya Grover Edward James Smith Y. Lipman FedML 33 90 0 07 Oct 2021
Vector Neurons: A General Framework for SO(3)-Equivariant Networks Congyue Deng Or Litany Yueqi Duan A. Poulenard Andrea Tagliasacchi Leonidas J. Guibas 3DPC 102 264 0 25 Apr 2021
The Open Catalyst 2020 (OC20) Dataset and Community Challenges L. Chanussot Abhishek Das Siddharth Goyal Thibaut Lavril Muhammed Shuaibi ... Brandon M. Wood Junwoong Yoon Devi Parikh C. L. Zitnick Zachary W. Ulissi 207 370 0 20 Oct 2020
PointNet: Deep Learning on Point Sets for 3D Classification and Segmentation C. Qi Hao Su Kaichun Mo Leonidas J. Guibas 3DH 3DPC 3DV PINN 210 13,886 0 02 Dec 2016