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DockPro: A VR-Based Tool for Protein-Protein Docking Problem
Author(s) -
Serdar Çakıcı,
Selçuk Sümengen,
Osman Uğur Sezerman,
Selim Balcısoy
Publication year - 2009
Publication title -
international journal of virtual reality
Language(s) - English
Resource type - Journals
eISSN - 2727-9979
pISSN - 1081-1451
DOI - 10.20870/ijvr.2009.8.2.2720
Subject(s) - docking (animal) , computer science , rendering (computer graphics) , workspace , macromolecular docking , protein–ligand docking , haptic technology , virtual screening , human–computer interaction , virtual reality , virtual machine , artificial intelligence , protein structure , bioinformatics , chemistry , biology , drug discovery , robot , nursing , medicine , biochemistry , operating system
Proteins are large molecules that are vital for all living organisms and they are essential components of many industrial products. The process of binding a protein to another is called protein-protein docking. Many automated algorithms have been proposed to find docking configurations that might yield promising protein-protein complexes. However, these automated methods are likely to come up with false positives and have high computational costs. Consequently, Virtual Reality has been used to take advantage of user’s experience on the problem; and proposed applications can be further improved. Haptic devices have been used for molecular docking problems; but they are inappropriate for protein-protein docking due to their workspace limitations. Instead of haptic rendering of forces, we provide a novel visual feedback for simulating physicochemical forces of proteins. We propose an interactive 3D application, DockPro, which enables domain experts to come up with dockings of protein-protein couples by using magnetic trackers and gloves in front of a large display.

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