jcsung/verticalerror
Computes the vertical square error of two isotherms
Developer Profile
jcsung
Discovered public repositories for jcsung in the GitHub catalog.
jcsung/gcmc-dlpoly
Grand Canonical Movie Creator for DL_POLY
jcsung/pdb2config
Quick and dirty program for converting a simple PDB file to DL_POLY CONFIG file with no PBCs
jcsung/interaction-list-count
Quick and dirty PHP script that consolidates and counts all of the unique interactions in a DL_POLY FIELD file. Only counts BOND, ANGLE, DIHEDRAL, and INVERSION interactions.
jcsung/qsum
Simplistic queue summary script for PBS/Torque batching system
jcsung/conf2xyz
Quick and dirty bash script, converts DL_POLY CONFIG file to XYZ file
jcsung/rotate
Quick and dirty program for rotating atoms around origin in PDB format
jcsung/move
Quick and dirty program for moving atoms in PDB format