Published November 26, 2024 | Version v2
Dataset Open

Targeting protein-ligand neosurfaces using a generalizable deep learning approach [benchmark dataset]

Authors/Creators

  • 1. ROR icon École Polytechnique Fédérale de Lausanne

Description

PDB files and processed surface meshes for the binder recovery benchmark. For the larger PDBbind decoy set only the PDB files are provided.

Files

pdbbind_decoys.zip

Files (10.5 GB)

Name Size
md5:2b45977254f45c6e229390cc62f3685d
10.0 GB Preview Download
md5:2f29c45a0db9464c62b4ad1e40a805a2
567.9 MB Preview Download

Additional details

Related works

Is described by
Preprint: 10.1101/2024.03.25.585721 (DOI)

Software

Repository URL
https://github.com/LPDI-EPFL/masif-neosurf