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Repository align_it
Name: align_it
Owner: bgruening
Synopsis: Align-it is a tool to align molecules according to their pharmacophores.
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.
Molecular modeling and/or screening based on pharmacophore similarities
has been proven to be an important and useful method in drug discovery.

Home page: http://silicos-it.be.s3-website-eu-west-1.amazonaws.com/software/align-it/1.0.4/align-it.html
License: GPL3+
Content homepage: http://silicos-it.be.s3-website-eu-west-1.amazonaws.com/software/align-it/1.0.4/align-it.html
Development repository: https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/silicos-it/align-it
Link to this repository: https://toolshed.g2.bx.psu.edu/view/bgruening/align_it/06d9381593a4
Clone this repository: hg clone https://toolshed.g2.bx.psu.edu/repos/bgruening/align_it
Type: unrestricted
Revision: 2:06d9381593a4
This revision can be installed: True
Times cloned / installed: 499

Contents of this repository

Valid tools - click the name to preview the tool and use the pop-up menu to inspect all metadata
Name Description Version Minimum Galaxy Version
and optimization (Align-it) 1.0.4+galaxy0 16.01
generation (Align-it) 0.1 16.01

Categories
Computational chemistry - Tools for use in computational chemistry