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1. SPMM SPMM Public

   [Nat. Comm. 2024] Multimodal learning for chemical domain, with SMILES and properties.

   Python 41 10

2. LDMol LDMol Public

   [ICML 2025] GitHub repository for LDMol, a latent text-to-molecule diffusion model.

   Python 21 9

3. ContrastiveCFG ContrastiveCFG Public

   A precise and stable CFG for negative prompts, derived via guided sampling with contrastive loss.

   Python 13 1

4. ITOC ITOC Public

   [ICLR 2026] Training-free, reward-guided image editing method by refining its sampling trajectory with Optimal Control.

   Python

5. ALBEF_tutorial ALBEF_tutorial Public

   ALBEF tutorial, with MIMIC-CXR data

   Python 2 2

6. VSEPR_angle_pytorch VSEPR_angle_pytorch Public

   Prediction of VSEPR bond angle & molecular shape using gradient descent.

   Python 1