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molecular-rectifier

Community

Given an RDKit molecule that does not sanitise, correct it until it does, regardless of the severity of the change.

Installation

To install this package, run one of the following:

Conda
$conda install conda-forge::molecular-rectifier

Usage Tracking

1.0.1
1.0.0
2 / 8 versions selected
Downloads (Last 6 months): 0

About

Summary

Given an RDKit molecule that does not sanitise, correct it until it does, regardless of the severity of the change.

Last Updated

Apr 5, 2024 at 11:17

License

MIT

Total Downloads

5.0K

Supported Platforms

noarch