pde10a

Here are 2 public repositories matching this topic...

chr13b / openfold3-pde10a-domain-adaption

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.

bioinformatics cheminformatics structural-biology pdb protein-structure drug-discovery umap domain-adaptation fine-tuning pose-prediction protein-ligand esm2 openfold3 co-folding pde10a morgan-fingerprint butina-clustering

Updated Jun 4, 2026
Python

missharismitha / pde10a-cofolding

Star

PDE10A protein-ligand co-folding analysis with OpenFold3 - built for the Apheris x OpenFold track at BioIncubate's Catalyst hackathon at ETH Zurich.

machine-learning bioinformatics hackathon structural-biology drug-discovery protein-structure-prediction openfold3 co-folding pde10a

Updated Aug 11, 2026
Python

Improve this page

Add a description, image, and links to the pde10a topic page so that developers can more easily learn about it.

Curate this topic

Add this topic to your repo

To associate your repository with the pde10a topic, visit your repo's landing page and select "manage topics."

Learn more