parmed.gromacs.GromacsGroFile

class parmed.gromacs.GromacsGroFile

Parses and writes Gromacs GRO files

Methods

id_format(filename)	Identifies the file as a GROMACS GRO file
parse(filename[, skip_bonds])	Parses a Gromacs GRO file
write(struct, dest[, precision, nobox, combine])	Write a Gromacs Topology File from a Structure

__init__(*args, **kwargs)

Initialize self. See help(type(self)) for accurate signature.

Methods

__init__(*args, **kwargs)	Initialize self.
id_format(filename)	Identifies the file as a GROMACS GRO file
parse(filename[, skip_bonds])	Parses a Gromacs GRO file
write(struct, dest[, precision, nobox, combine])	Write a Gromacs Topology File from a Structure