Published March 17, 2020 | Version v1.1.0
Software Open

chemprop-reaction: Release version 1.1.0

Creators

  • 1. MIT
  • 2. CSAIL, Massachusetts Institute of Technology

Description

Message Passing Neural Networks for Molecule and Reaction Property Prediction

Files

cgrambow/chemprop-v1.1.0.zip

Files (461.4 MB)

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Additional details

Related works

Is supplement to
https://github.com/cgrambow/chemprop/tree/v1.1.0 (URL)