Active site sequence representation of human kinases outperforms full sequence for affinity prediction
- Jannis Born
- Tien Huynh
- et al.
- 2021
- NeurIPS 2021
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80 results for Matteo Manica
PaccMannRL: Designing anticancer drugs from transcriptomic data via reinforcement learning
- Jannis Born
- Matteo Manica
- et al.
- 2019
- NeurIPS 2019
PaccMann: Prediction of anticancer compound sensitivity with multi-modal attention-based neural networks
- Ali Kazemi Oskooei
- Jannis Born
- et al.
- 2018
- NeurIPS 2018
Artificial intelligence driven design of catalysts and materials for ring opening polymerization using a domain-specific language
- Nathaniel H. Park
- Matteo Manica
- et al.
- 2023
- Nature Communications
Accelerating material design with the generative toolkit for scientific discovery
- Matteo Manica
- Jannis Born
- et al.
- 2023
- npj Computational Materials
Regression Transformer enables concurrent sequence regression and generation for molecular language modelling
- Jannis Born
- Matteo Manica
- 2023
- Nature Machine Intelligence
Biocatalysed synthesis planning using data-driven learning
- Daniel Probst
- Matteo Manica
- et al.
- 2022
- Nature Communications
Network-based Biased Tree Ensembles (NetBiTE) for Drug Sensitivity Prediction and Drug Sensitivity Biomarker Identification in Cancer
- Ali Oskooei
- Matteo Manica
- et al.
- 2019
- Scientific Reports
PIMKL: Pathway-Induced Multiple Kernel Learning
- Matteo Manica
- Joris Cadow
- et al.
- 2019
- npj Systems Biology and Applications
Growing strings in a chemical reaction space for searching retrosynthesis pathways
- 2024
- npj Computational Materials