[docs]class PDBSaveOptions(object):
"""
| Options for saving PDB files.
| Includes options for writing:
| - hydrogens
| - TER records
| - bonds
| - heterogen bonds
| - only selected atoms
"""
def __init__(self):
self.write_hydrogens = True
self.write_ters = True
self.write_bonds = False
self.write_het_atoms = True
self.write_het_bonds = True
self.only_save_these_atoms = None
[docs]class SDFSaveOptions(object):
"""
| Options for saving SDF files.
| Includes options for writing:
| - all bonds
| - heterogen bonds
"""
def __init__(self):
self.write_all_bonds = True
self.write_het_bonds = True
[docs]class MMCIFSaveOptions(object):
"""
| Options for saving MMCIF files.
| Includes options for writing:
| - hydrogens
| - only selected atoms
"""
def __init__(self):
self.write_hydrogens = True
self.only_save_these_atoms = None