fix the error for labeling of invalid trajectories #143
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This is a simple bugfix for invalid molecules, which cannot be found in current gflownet scripts.
This fix can be useful when applying drug-like filters, such as Lipinski's Ro5 or Veber's rule.
I have confirmed that this fix works well:
https://github.com/SeonghwanSeo/RxnFlow/blob/master/src/rxnflow/tasks/unidock.py