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* [X] RDKIT [[paper]() [code](https://www.rdkit.org/)]. The standard library for chemoinformatics in `python`. It calculates several fingerprints and also does 3D conformational sampling.
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* [X] Silicos-IT [[web](http://silicos-it.be.s3-website-eu-west-1.amazonaws.com/) [code](http://silicos-it.be.s3-website-eu-west-1.amazonaws.com/software/biscu-it/biscu-it.html)]. It has implementations for the [chemical beauty](https://www.ncbi.nlm.nih.gov/pubmed/22270643) score (QED).
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* [ ] Synthetic accessibility score [[code](https://github.com/mkusner/grammarVAE/blob/master/molecule_optimization/latent_features_and_targets_character/sascorer.py)]. A simple synthetic accessibility score.
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* [ ] TF3P fingerprint [[paper](https://arxiv.org/pdf/1912.11430.pdf) [code](https://github.com/canisw/tf3p)]
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### `B` Targets
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