https://github.com/insilichem/tangram_subalign

Align two, potentially different, molecules based on partial matches of substructures in UCSF Chimera
https://github.com/insilichem/tangram_subalign

rdkit ucsf-chimera

Last synced: 14 days ago
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Align two, potentially different, molecules based on partial matches of substructures in UCSF Chimera

• Host: GitHub
• URL: https://github.com/insilichem/tangram_subalign
• Owner: insilichem
• Created: 2017-11-03T17:10:23.000Z (over 8 years ago)
• Default Branch: master
• Last Pushed: 2019-03-24T22:59:27.000Z (over 7 years ago)
• Last Synced: 2025-02-25T09:18:56.013Z (over 1 year ago)
• Topics: rdkit, ucsf-chimera
• Language: Python
• Homepage: http://tangram-suite.readthedocs.io/en/latest/tangram_subalign.html
• Size: 27.3 KB
• Stars: 2
• Watchers: 3
• Forks: 1
• Open Issues: 3
• Metadata Files:
  • Readme: README.md

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README

          
# Tangram SubAlign

A UCSF Chimera plugin that enables a `subalign` command to align small molecules, even with only partial overlap.

# Requirements

This plugin needs [RDKit](http://www.rdkit.org/).