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align_it

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Align-it is a tool to align molecules according to their pharmacophores. A pharmacophore is an abstract concept based on the specific interactions observed in drug-receptor interactions: hydrogen bonding, charge transfer, electrostatic and hydrophobic interactions.

Installation

To install this package, run one of the following:

Conda
$conda install bioconda::align_it

Usage Tracking

1.0.4
1.0.3
2 / 8 versions selected
Downloads (Last 6 months): 0

About

Summary

Align-it is a tool to align molecules according to their pharmacophores. A pharmacophore is an abstract concept based on the specific interactions observed in drug-receptor interactions: hydrogen bonding, charge transfer, electrostatic and hydrophobic interactions.

Last Updated

Sep 10, 2021 at 06:57

License

LGPL

Total Downloads

20.4K

Supported Platforms

linux-64