DUMPFormatter

class sknano.io.lammps_dump.DUMPFormatter(style=None, dumpattrs=None, dumpattrmap=None, atomattrmap=None)

Bases: sknano.io.StructureIOFormatter

Class defining the structure file format for LAMMPS dump.

Parameters:

• style (str, optional) –
• dumpattrs (list, optional) –
• dumpattrmap (class:dict) – Python dict mapping custom dump attributes to Atom attributes.
• atomattrmap (dict) – dict mapping atom type to atom element

style

dumpattrs2index

Attributes

atomattrs	List of dump atom attributes.
attr_dtypes	List of dump atom attributes.
dumpattrs	List of dump attributes.
fmtstr	Format string.
otherattrs	List of other dump atom attributes.

Methods

atomattrs2str()	Return a space-separated string of parsed atom attributes.
dumpattrs2str()	Return a space-separated string of the dumped atom attributes.
format(attrs[, attr_dtypes])	Return str of dump attributes formatted for an output stream.
remapdumpattrs(dumpattrs, dumpattrmap)	Rename attributes in the DUMPFormatter.dumpattrs list.
todict()	Return dict of constructor parameters.

Attributes Summary

atomattrs	List of dump atom attributes.
attr_dtypes	List of dump atom attributes.
dumpattrs	List of dump attributes.
otherattrs	List of other dump atom attributes.

Methods Summary

atomattrs2str()	Return a space-separated string of parsed atom attributes.
dumpattrs2str()	Return a space-separated string of the dumped atom attributes.
format(attrs[, attr_dtypes])	Return str of dump attributes formatted for an output stream.
remapdumpattrs(dumpattrs, dumpattrmap)	Rename attributes in the DUMPFormatter.dumpattrs list.
todict()	Return dict of constructor parameters.

Attributes Documentation

atomattrs

List of dump atom attributes.

attr_dtypes

List of dump atom attributes.

dumpattrs

List of dump attributes.

otherattrs

List of other dump atom attributes.

Methods Documentation

atomattrs2str()

Return a space-separated string of parsed atom attributes.

dumpattrs2str()

Return a space-separated string of the dumped atom attributes.

format(attrs, attr_dtypes=None)

Return str of dump attributes formatted for an output stream.

Parameters:attrs (list) – List of dump attribute values.

remapdumpattrs(dumpattrs, dumpattrmap)

Rename attributes in the DUMPFormatter.dumpattrs list.

Parameters:dumpattrmap (dict) – dict mapping atom attribute name to new attribute name.

todict()

Return dict of constructor parameters.