Published July 12, 2022 | Version 3.0
Software Open

A new schrodinger-pymol plugin for multiple dlg file parser and autodock vina output file parser

  • 1. Madras Medical College

Description

This is a schrodinger-pymol plugin.Install this plugin like anyother plugin in pymol. This pugin is platform independent and  works on windows, linux all distros, and mac. This plugin is used to view the docking scores of autodock and autodock vina in pymol. This plugin is usefull while analysing hundreds of dlg files and vina output files. To view the docking scores enter the main docking folder location.

dock folder - it is the single autodock folder where dlg file is present

main docking folder - it contain many autodock subfolders

when dlg file is given - docking score of that compound will be displayed

when dock folder is given - docking score of that compound will be displayed

when main docking folder is given - docking score of all the subfolders will be displayed

To get docking score of autodock vina enter the main folder name as input. It will show the docking score along with output ligand name.

Files

Docking_score_parser_pymol_plugin.zip

Files (17.0 kB)

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md5:5dac4cdb761f7ec995053fd66b9f174f
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References