6.4. DL_Poly format reader MDAnalysis.coordinates.DLPoly

Read DL Poly format coordinate files

class MDAnalysis.coordinates.DLPoly.ConfigReader(filename, convert_units=True, n_atoms=None, **kwargs)[source]

DLPoly Config file Reader

New in version 0.11.0.

Changed in version 2.0.0: coordinates, velocities, and forces are no longer stored in ‘F’ memory layout, instead now using the numpy default of ‘C’.

class MDAnalysis.coordinates.DLPoly.HistoryReader(filename, **kwargs)[source]

Reads DLPoly format HISTORY files

New in version 0.11.0.


Close the trajectory file.