Active site sequence representation of human kinases outperforms full sequence for affinity prediction and inhibitor generation: 3D effects in a 1D model
- Jannis Born
- Tien Huynh
- et al.
- 2022
- ACS Spring 2022
Publications
Active site sequence representation of human kinases outperforms full sequence for affinity prediction
- Jannis Born
- Tien Huynh
- et al.
- 2021
- NeurIPS 2021
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
Projects
AI for Scientific Discovery
Creating the AI-enabled lab for a new era of reproducible and collaborative experimentation
Lab that Learns
Leveraging AI foundation models and multi-cloud computing to usher in a new era of reproducible and collaborative experimentation for scientific discovery.
Blog posts
Neural networks take TITAN-sized step toward T cell specificity prediction
ResearchAnna Weber, Jannis Born, and María Rodríguez Martínez5 minute read- Healthcare
- Life Sciences
- Science
Top collaborators
MM
Matteo Manica
Senior Research Scientist
TL
Teodoro Laino
Distinguished RSM, Manager
DC
MR
Marianna Rapsomaniki
Staff Research Scientist