PaccMannRL: De novo generation of hit-like anticancer molecules from transcriptomic data via reinforcement learning
- Jannis Born
- Matteo Manica
- et al.
- 2021
- iScience
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Data-driven molecular design for discovery and synthesis of novel ligands: A case study on SARS-CoV-2
- Jannis Born
- Matteo Manica
- et al.
- 2021
- Machine Learning: Science and Tech.