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OptiMaL-PSE-Lab / EvalRetro

A repository for evaluating single-step retrosynthesis algorithms
MIT License
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Re-scaling of metrics #6

Closed fredhastedt closed 7 months ago

fredhastedt commented 7 months ago

This commit addresses three concerns:

  1. Scale of metrics: All metrics are now scaled between 0-1 with 1 being the best
  2. Forward model: Previously, the verbosity of the forward model was extremely high if k_forward != 2. This is no fixed.
  3. Argparse: Boolean values can now be passed as: ["True", "true", "yes", "y"] to main.py