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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1.4 //Size of sphere that rolls over dms file surface for cavities | 1.4 //Size of sphere that rolls over dms file surface for cavities | ||
[your_receptor].sph | [your_receptor].sph | ||
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Revision as of 15:31, 12 February 2020
Introduction
Generate an INSPH file
A Header
hi
[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
