biotite.structure.io.mol.get_structure¶
- biotite.structure.io.mol.get_structure(mol_file)[source]¶
Get an
AtomArray
from the MOL file.Ths function is a thin wrapper around
MOLFile.get_structure()
.- Parameters
- mol_fileMOLFile
The MOL file.
- Returns
- arrayAtomArray
This
AtomArray
contains the optionalcharge
annotation and has an associatedBondList
. All other annotation categories, exceptelement
are empty.