Published September 21, 2019 | Version 2.2
Software Open

EasyDockVina: Graphical Interface for Ligand Optimization and High Throughput Virtual Screening with Vina

Creators

  • 1. Department of Pharmacology, Faculty of Pharmacy, International University of Africa, Khartoum, Sudan.

Description

Graphical Interface for Ligand Optimization and High Throughput Virtual Screening with Vina

  • Features:
  • Simple graphical interface.
  • Protein preparation.
  • Ligand preparation (single or multiple ligands).
  • Support more than 100 file extension (mol, mol2,pdb ..etc)
  • Perform molecular docking of multiple ligands against single target protein (able to process more than 100,000 ligands).

  • Convenient results handling, docking energies are saved in both txt and csv formats.

  • Youtube Tutorial: https://www.youtube.com/watch?v=oqKsSJ_uWGs

  • Download v2.2:

https://mega.nz/#!vpoxlYhT!AU4J_yxb6H121jJ_G_K9NvJMbkESyIugP0InI_pcTu4

  • For bugs/feedback reporting:

s3cr3tsdn[at]gmail.com or facebook.com/auth.phtml

Files

S3cr3t-SDN/EasyDockVina2-2.2.zip

Files (681 Bytes)

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md5:4811a577b4a27c9adfeed21f1c4705dc
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Additional details

Related works

Is supplement to
https://github.com/S3cr3t-SDN/EasyDockVina2/tree/2.2 (URL)