Converting MD trajectories from NWChem to anything VMD can read.

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Forum >> NWChem's corner >> Running NWChem >> Converting MD trajectories from NWChem to anything VMD can read.

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9:51:46 AM PST - Fri, Dec 30th 2011
The analysis module can convert NWChem trj files into Amber crd, Discover arc or Charmm dcd files. See the 'copy' directive in the trajectory file conversion section. Individual frames out of a trajectory can be converted into pdb or xyz format using the 'write' directive.


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