parmed.formats.pdbx.PdbxWriter module

Classes for writing data and dictionary containers in PDBx/mmCIF format.

class parmed.formats.pdbx.PdbxWriter.PdbxWriter(ofh=<_io.TextIOWrapper name='<stdout>' mode='w' encoding='UTF-8'>)

Bases: object

Write PDBx data files or dictionaries using the input container or container list.

Methods

setRowPartition(numRows)

Maximum number of rows checked for value length and format

write
writeContainer

setRowPartition(numRows)

Maximum number of rows checked for value length and format

write(containerList)

writeContainer(container)