Virtual_Screening

Screening tools for large batches of drugs using AutoDock Vina tools. Two tcl scripts are for visulalizing and getting target box size.

Name		Name	Last commit message	Last commit date
Latest commit History 2 Commits
README.md		README.md
babel.sh		babel.sh
box_molecule.tcl		box_molecule.tcl
conf.txt		conf.txt
draw_box.tcl		draw_box.tcl
flex_pdbqt.sh		flex_pdbqt.sh
listligand.sh		listligand.sh
pdbqt.sh		pdbqt.sh
run.sh		run.sh
scoring.pl		scoring.pl
screenig.pl		screenig.pl
screenig_flex.pl		screenig_flex.pl

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