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MUDiff: Unified Diffusion for Complete Molecule Generation

v1v2v3 (latest)

MUDiff: Unified Diffusion for Complete Molecule Generation

LOG IN (LOG IN), 2023

28 April 2023

Sitao Luan

ArXiv (abs)PDF HTML

Papers citing "MUDiff: Unified Diffusion for Complete Molecule Generation"

13 / 13 papers shown

FlexiFlow: decomposable flow matching for generation of flexible molecular ensemble

FlexiFlow: decomposable flow matching for generation of flexible molecular ensemble

Riccardo Tedoldi

Hossein Azizpour

Alessandro Tibo

228

0

0

21 Nov 2025

Exploring Heterophily in Graph-level Tasks

Exploring Heterophily in Graph-level Tasks

128

0

0

23 Sep 2025

PowerGrow: Feasible Co-Growth of Structures and Dynamics for Power Grid Synthesis

PowerGrow: Feasible Co-Growth of Structures and Dynamics for Power Grid Synthesis

171

3

0

29 Aug 2025

FlowMol3: Flow Matching for 3D De Novo Small-Molecule Generation

FlowMol3: Flow Matching for 3D De Novo Small-Molecule Generation

272

9

0

18 Aug 2025

Learning Flexible Forward Trajectories for Masked Molecular Diffusion

Learning Flexible Forward Trajectories for Masked Molecular Diffusion

711

2

0

22 May 2025

Clifford Group Equivariant Diffusion Models for 3D Molecular Generation

Clifford Group Equivariant Diffusion Models for 3D Molecular Generation

Sharvaree P. Vadgama

425

3

0

22 Apr 2025

Straight-Line Diffusion Model for Efficient 3D Molecular Generation

Straight-Line Diffusion Model for Efficient 3D Molecular Generation

456

8

0

04 Mar 2025

A Survey of Graph Transformers: Architectures, Theories and Applications

A Survey of Graph Transformers: Architectures, Theories and Applications

Ercan Engin Kuruoglu

522

16

0

23 Feb 2025

NExT-Mol: 3D Diffusion Meets 1D Language Modeling for 3D Molecule Generation

NExT-Mol: 3D Diffusion Meets 1D Language Modeling for 3D Molecule GenerationInternational Conference on Learning Representations (ICLR), 2025

Kenji Kawaguchi

568

19

0

18 Feb 2025

LayerDAG: A Layerwise Autoregressive Diffusion Model for Directed Acyclic Graph Generation

LayerDAG: A Layerwise Autoregressive Diffusion Model for Directed Acyclic Graph GenerationInternational Conference on Learning Representations (ICLR), 2024

Srinivas Sridharan

419

8

0

04 Nov 2024

3D Vessel Graph Generation Using Denoising Diffusion

3D Vessel Graph Generation Using Denoising Diffusion

Chinmay Prabhakar

Tamaz Amiranashvili

Johannes C. Paetzold

Hongwei Bran Li

214

9

0

08 Jul 2024

Effective Protein-Protein Interaction Exploration with PPIretrieval

Effective Protein-Protein Interaction Exploration with PPIretrieval

Connor W. Coley

Guy Wolf

Shuangjia Zheng

208

4

0

06 Feb 2024

MiDi: Mixed Graph and 3D Denoising Diffusion for Molecule Generation

MiDi: Mixed Graph and 3D Denoising Diffusion for Molecule Generation

Clément Vignac

367

101

0

17 Feb 2023

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