5.3. DL Poly format Topology Readers — MDAnalysis.topology.DLPolyParser

Read DL Poly format topology files

DLPoly files have the following Attributes:

  • Atomnames

  • Atomids

Note

By default, atomtypes and masses will be guessed on Universe creation. This may change in release 3.0. See Guesser modules for more information.

5.3.1. Classes

class MDAnalysis.topology.DLPolyParser.ConfigParser(filename)[source]

DL_Poly CONFIG file parser

Added in version 0.10.1.

Changed in version 2.8.0: Removed type and mass guessing (attributes guessing takes place now through universe.guess_TopologyAttrs() API).

class MDAnalysis.topology.DLPolyParser.HistoryParser(filename)[source]

DL_Poly History file parser

Added in version 0.10.1.