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fix cofactor name
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jthorton committed Dec 12, 2024
1 parent 58ce1a4 commit d8fc66e
Showing 1 changed file with 1 addition and 1 deletion.
Original file line number Diff line number Diff line change
Expand Up @@ -112,7 +112,7 @@ def __call__(
RFEComponentLabels.PROTEIN: self.protein,
}
for i, c in enumerate(self.cofactors):
components.update({f'{RFEComponentLabels.COFACTOR}{i+1}': c})
components.update({f'{RFEComponentLabels.COFACTOR.value}{i+1}': c})
if self.solvent is not None:
components.update({RFEComponentLabels.SOLVENT: self.solvent})
chem_sys = ChemicalSystem(
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