A SEAMM plugin for A SEAMM plug-in for RDKit
Project description
SEAMM RDKit Plug-in
A SEAMM plug-in for RDKit
Free software: BSD-3-Clause
Documentation: https://molssi-seamm.github.io/rdkit_step/index.html
Features
Please edit this section!
Acknowledgements
This package was created with Cookiecutter and the molssi-seamm/cookiecutter-seamm-plugin project template.
Developed by the Molecular Sciences Software Institute (MolSSI), which receives funding from the National Science Foundation under award ACI-1547580
History
- 2023.2.22 – Fixed bug with dialog
Fixed bug creating dialog, due to changes in code SEAMM code.
Made the dialog fit most of the window to make it easier to use.
- 2022.1.11.1 – Initial release!
The initial release of a SEAMM plug-in providing access the to features (descriptors) available in RDKit.
This version fixes a minor problem with the citation of the plug-in itself.
2022.1.11 – Initial release!
- 2021.9.16 (2021-09-16)
Plug-in created using the SEAMM plug-in cookiecutter.
Release history Release notifications | RSS feed
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
Built Distribution
Hashes for rdkit_step-2023.2.22-py2.py3-none-any.whl
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 | fcc999ecdd5ec2a4c4773360ba796238fe6a168c46235556f652fcee8a93cdb5 |
|
| MD5 | fe8ef59aed7e4b4fedcfa330b1a4f214 |
|
| BLAKE2b-256 | fad83eaa5a77440703e0fbaadda799389e55c133f791450bcf835dc29460a1a1 |
