gmol.base.data.mmcif.write

This module is written to follow the syntax rules in the reference below.

Reference:

CIF 1.1 syntax (general): https://www.iucr.org/resources/cif/spec/version1.1/cifsyntax#general

Functions

mmcif_bond_order(order)
mmcif_bool(pred)
mmcif_write_block(block, fields, data)

mmcif_bond_order(order: int) → str

mmcif_bool(pred: bool) → str

mmcif_write_block(block: str, fields: Sequence[str], data: Sequence[Sequence[str | int]]) → str