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pose-prediction

Here are 11 public repositories matching this topic...

2dimageto3dmodel

We evaluate our method on different datasets (including ShapeNet, CUB-200-2011, and Pascal3D+) and achieve state-of-the-art results, outperforming all the other supervised and unsupervised methods and 3D representations, all in terms of performance, accuracy, and training time.

  • Updated Mar 4, 2024
  • Python

A measured benchmark of three docking scoring functions on 308 protein-ligand complexes, reporting pose accuracy and physical validity together, with the success rate recomputed after removing the crystal starting conformer and the ligand-centred search box.

  • Updated Sep 26, 2026
  • Python

Fine-tuning OpenFold3 (4.0.0) for PDE10A protein–ligand pose prediction via distribution-aware PDB-scale data augmentation: +0.20 PL LDDT, −2.3 Å ligand RMSD on held-out.

  • Updated Jun 4, 2026
  • Python

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