There is a newer version of the record available.

Published September 4, 2019 | Version v1
Poster Open

Deep Learning Scoring Function for Flexible Molecular Docking

Creators

  • 1. University of Oxford
  • 2. University of Pittsburgh

Description

Development of a deep learning scoring function for docking with flexible side chains, based on the deep learning framework for molecular docking gnina.

 

Google Summer of Code 2019 project under the OpenChemistry organization.

Files

Meli-Flash-AIChem19.pdf

Files (16.6 MB)

Name Size Download all
md5:61ac09a5e16be613e439acaea3405793
10.5 MB Preview Download
md5:a7d67f184ffeea946b9d3013866bbc14
6.1 MB Preview Download