pycgtool.parsers.itp

Module containing classes used to parse ITP/TOP file format.

Module Contents

Classes

ITP

Class representing an .itp file.

Attributes

logger

pycgtool.parsers.itp.logger
class pycgtool.parsers.itp.ITP(filepath: Optional[PathLike] = None)[source]

Bases: pycgtool.parsers.cfg.CFG

Class representing an .itp file.

Contains a dictionary of sections for every molecule definition.

_read_file(self, filepath: pathlib.Path)None[source]