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Bug summary
Element information in a CIF file is not loaded properly.
Code to reproduce the behavior
Please include a code snippet that can be used to reproduce this bug.
from mbuild.lattice import load_cif lattice_cif_ETV_triclinic = load_cif( #this cif file has oxygen atoms in it file_or_path=get_fn("ETV_triclinic.cif") ) ETV_triclinic = lattice_cif_ETV_triclinic.populate(x=1, y=1, z=1) for part in ETV_triclinic.particles(): assert part.element
Software versions
python -c "import mbuild as mb; print(mb.__version__)"
python --version
The text was updated successfully, but these errors were encountered:
CalCraven
Successfully merging a pull request may close this issue.
Bug summary
Element information in a CIF file is not loaded properly.
Code to reproduce the behavior
Please include a code snippet that can be used to reproduce this bug.
Software versions
python -c "import mbuild as mb; print(mb.__version__)"
) 0.15.1python --version
)? 3.9The text was updated successfully, but these errors were encountered: