nmrgnn

Chemical shift predictor

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install nmrgnn

Releases

Version Released Buster
Python 3.7
Bullseye
Python 3.9
Bookworm
Python 3.11
Files
0.7 2021-08-31    
0.6 2021-08-27    
0.5 2021-08-23    
0.4 2021-08-19    
0.3 2021-08-16    

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Page last updated 2023-10-28 03:27:37 UTC