Diffusion-Driven Generative Framework for Molecular Conformation Prediction

22 December 2023

Papers citing "Diffusion-Driven Generative Framework for Molecular Conformation Prediction"

5 / 5 papers shown

Title
Inverse design of 3d molecular structures with conditional generative neural networks Niklas W. A. Gebauer M. Gastegger Stefaan S. P. Hessmann Klaus-Robert Muller Kristof T. Schütt AI4CE 187 166 0 10 Sep 2021
Diffusion Probabilistic Models for 3D Point Cloud Generation Shitong Luo Wei Hu 3DPC 178 721 0 02 Mar 2021
E(3)-Equivariant Graph Neural Networks for Data-Efficient and Accurate Interatomic Potentials Simon L. Batzner Albert Musaelian Lixin Sun Mario Geiger J. Mailoa M. Kornbluth N. Molinari Tess E. Smidt Boris Kozinsky 190 1,229 0 08 Jan 2021
Bilevel Programming for Hyperparameter Optimization and Meta-Learning Luca Franceschi P. Frasconi Saverio Salzo Riccardo Grazzi Massimiliano Pontil 99 715 0 13 Jun 2018
Junction Tree Variational Autoencoder for Molecular Graph Generation Wengong Jin Regina Barzilay Tommi Jaakkola 219 1,332 0 12 Feb 2018