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Baselines and evaluation scripts #248
Merged
AlexandraVolokhova
merged 25 commits into
conformer_ai4mat23
from
rdkit_cluster_baseline
Feb 16, 2024
Merged
Baselines and evaluation scripts #248
AlexandraVolokhova
merged 25 commits into
conformer_ai4mat23
from
rdkit_cluster_baseline
Feb 16, 2024
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…net into rdkit_cluster_baseline
…net into rdkit_cluster_baseline
…flownet into rdkit_cluster_baseline
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RDkit and RDkit + clustering baselines scripts, evaluation scripts for generated conformations