Thirty GA runs are performed with 1 neutral ligand configurations and sixteen GA runs with the 2 neutral ligands configurations. We take the final population of all of these GA runs and obtain 1332 unique catalysts for the 1 neutral ligand and 747 unique catalysts for the 2 neutral ligand configurations. As a first step of validating these catalysts, a thorough conformer search is performed for each catalyst. This is in essence re-doing the scoring for all catalysts with a significantly higher number of conformers. However, the SA score is not considered at this stage as we are no longer evolving ligands.