Coloring and Subcluster Matching: Difference between revisions

From DISI
Jump to navigation Jump to search
No edit summary
No edit summary
Line 5: Line 5:
=== 1.1 Create a directory and copy necessary files from your original receptor preparation folders ===
=== 1.1 Create a directory and copy necessary files from your original receptor preparation folders ===


define
set workdir = /where you want to run your coloring and subcluster matching/
  mkdir -p ${workdir}
  mkdir -p ${workdir}
  cd ${workdir}
  cd ${workdir}


For coloring your matching sphere, you must have
For coloring your matching sphere, you must have

Revision as of 18:30, 31 March 2021

Written by Jiankun Lyu on March 31st, 2021.

1. Generate colored matching spheres

1.1 Create a directory and copy necessary files from your original receptor preparation folders

set workdir = /where you want to run your coloring and subcluster matching/
mkdir -p ${workdir}
cd ${workdir}

For coloring your matching sphere, you must have