DTA-GNN: Target-Specific Binding Affinity Dataset Builder and GNN Trainer

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Title: DTA-GNN: Target-Specific Binding Affinity Dataset Builder and GNN Trainer
DOI: https://doi.org/10.82595/scilifelab.s788b-g2175
Description: Build leakage-free Drug-Target Affinity datasets from ChEMBL and train Graph Neural Networks for target-specific binding affinity prediction
URL: https://dta-gnn.serve.scilifelab.se
Source code: https://github.com/gozsari/DTA-GNN
Docker image: ghcr.io/gozsari/dta-gnn-for-serve:for-serve-fc6fb6fed2732a3e3b1f355261c933ce47d15453@sha256:b4067ce955e5eee8da95766e383ccb3b739cccf9342a0a102bdb8c480c8f4c39
Date submitted: 2026-01-30 00:43
Date updated: 2026-08-31 22:50
Date available: 2026-04-26 08:28

Özsari, Gökhan

Version 1:
https://doi.org/10.82595/scilifelab.s788b-g2175 current

To cite all versions, use the following DOI:
https://doi.org/10.82595/scilifelab.rn5ea-gqt71