Harmonic Self-Conditioned Flow Matching for Multi-Ligand Docking and Binding Site Design

9 October 2023

Papers citing "Harmonic Self-Conditioned Flow Matching for Multi-Ligand Docking and Binding Site Design"

8 / 8 papers shown

Title
polyGen: A Learning Framework for Atomic-level Polymer Structure Generation Ayush Jain Rampi Ramprasad 48 0 0 24 Apr 2025
FlowDock: Geometric Flow Matching for Generative Protein-Ligand Docking and Affinity Prediction Alex Morehead Jianlin Cheng OOD 117 2 0 14 Dec 2024
Deep Learning for Protein-Ligand Docking: Are We There Yet? Alex Morehead Nabin Giri Jian Liu Jianlin Cheng Jianlin Cheng OOD 40 4 0 23 May 2024
Multisample Flow Matching: Straightening Flows with Minibatch Couplings Aram-Alexandre Pooladian Heli Ben-Hamu Carles Domingo-Enrich Brandon Amos Y. Lipman Ricky T. Q. Chen 60 126 0 28 Apr 2023
Stochastic Interpolants: A Unifying Framework for Flows and Diffusions M. S. Albergo Nicholas M. Boffi Eric Vanden-Eijnden DiffM 257 262 0 15 Mar 2023
DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking Gabriele Corso Hannes Stärk Bowen Jing Regina Barzilay Tommi Jaakkola DiffM 139 410 0 04 Oct 2022
PiFold: Toward effective and efficient protein inverse folding Zhangyang Gao Cheng Tan Pablo Chacón Stan Z. Li AI4CE 67 104 0 22 Sep 2022
Likelihood Training of Schrödinger Bridge using Forward-Backward SDEs Theory T. Chen Guan-Horng Liu Evangelos A. Theodorou DiffM OT 174 164 0 21 Oct 2021