Coordinates Manipulation: Difference between revisions

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Latest revision as of 06:54, 4 July 2018

Navigation: Documentation / Commands / Coordinates Manipulation


Command Description
topcrd2crd convert coordinates from one format to the other
topcrd2mmcom convert topology and coordinates into the gaussian input file with the force field parameters
xyzfit RMSD fit between two xyz structures
xyzsplit split xyz structure into individual molecules