Poster "3d molecule generation" Papers

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Accelerating 3D Molecule Generation via Jointly Geometric Optimal Transport

Haokai Hong, Wanyu LIN, KC Tan

ICLR 2025arXiv:2405.15252

Accelerating 3D Molecule Generative Models with Trajectory Diagnosis

Zhilong Zhang, Yuxuan Song, Yichun Wang et al.

Manipulating 3D Molecules in a Fixed-Dimensional E(3)-Equivariant Latent Space

Zitao Chen, Yinjun Jia, Zitong Tian et al.

NEURIPS 2025arXiv:2506.00771

Straight-Line Diffusion Model for Efficient 3D Molecular Generation

Yuyan Ni, Shikun Feng, Haohan Chi et al.

NEURIPS 2025arXiv:2503.02918

Interaction-based Retrieval-augmented Diffusion Models for Protein-specific 3D Molecule Generation

Zhilin Huang, Ling Yang, Xiangxin Zhou et al.