Skip to content
master
Go to file
Code

Latest commit

 

Git stats

Files

Permalink
Failed to load latest commit information.
Type
Name
Latest commit message
Commit time
 
 
 
 
 
 
 
 
 
 
 
 

README.md

Script to perform reactions on molecules using RDKIT

Install

Requirements:

pip install git+https://github.com/3D-e-Chem/rdkit-react.git

Usage

react --smarts reactions.smarts input.sd output.sd

About

Script to perform reactions on molecules using RDKIT

Resources

License

Releases

No releases published

Packages

No packages published

Languages

You can’t perform that action at this time.