chemprop

Molecular Property Prediction with Message Passing Neural Networks

Installation

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

pip3 install chemprop

Releases

Version Released Bullseye
Python 3.9
Bookworm
Python 3.11
Files
2.1.2 2025-03-03    
2.1.1 2025-01-29    
2.1.0 2024-10-23    
2.0.5 2024-10-12    
2.0.4 2024-07-30    
2.0.3 2024-06-28    
2.0.2 2024-06-14    
2.0.1 2024-06-06    
2.0.0 2024-04-23    
2.0.0rc1 pre-release 2024-03-04    
1.7.1 2024-04-12    
1.7.0 2024-03-04    
1.6.1 2023-08-01  
1.6.1.dev0 pre-release 2024-02-29    
1.6.0 yanked 2023-07-20  
1.5.2 2022-07-20  
1.5.1 2022-05-01  
1.5.0 2022-04-30  
1.4.1 2022-01-24  
1.3.1 2021-07-28  
1.3.0 2021-04-26  
1.2.0 2021-01-26  
1.1.0 2020-10-25  
1.0.2 2020-07-25  
1.0.1 2020-07-25  
1.0.0 2020-07-25    

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Page last updated 2025-03-03 22:28:05 UTC