Difference between revisions of "2020 DOCK tutorial 1 with PDBID 3VJK"
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Generate an INSPH file | Generate an INSPH file | ||
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[your_receptor].dms | [your_receptor].dms | ||
R //Spheres will be generated outside the protein surface | R //Spheres will be generated outside the protein surface | ||
Revision as of 15:18, 12 February 2020
Introduction
Generate an INSPH file
[your_receptor].dms R //Spheres will be generated outside the protein surface X //All points are used 0.0 //Distance that steric interactions are checked 4.0 //Maximum sphere radius of generated sphere 1.4 //Size of sphere that rolls over dms file surface for cavities [your_receptor].sph
