Publications

759 results for Life Sciences

Predicting HLA-peptide complex immunogenicity with molecular dynamics and graph convolutional deep learning
- - Jeff Weber
- 2022
- ACS Fall 2022
Attempting Activity Modulation by Graph-based Small-Molecule Generative Modeling: Analysis on Training and Seed Bias and Implication of AI-driven Drug Discovery
- - Seung Gu Kang
- 2022
- ACS Fall 2022
Identification of enzymatic active sites with unsupervised language modelling
- - Loic Kwate Dassi
  - Matteo Manica
  - et al.
- 2022
- ACS Fall 2022
CASTELO — a combined machine learning and molecular modeling for drug discovery and protein-protein interaction optimization
- - Leili Zhang
- 2022
- ACS Fall 2022
Guiding multistep retrosynthesis planning with continuous pathway representations
- - Jannis Born
  - Matteo Manica
  - et al.
- 2022
- ACS Fall 2022
A Fully Differentiable Set Autoencoder
- - Nikita Janakarajan
  - Jannis Born
  - et al.
- 2022
- KDD 2022
Multimodal Prediction of Five-Year Breast Cancer Recurrence in Women Who Receive Neoadjuvant Chemotherapy
- - Simona Rabinovici-Cohen
  - Xosé M. Fernández
  - et al.
- 2022
- Cancers
Two-age islet-autoantibody screening for childhood type 1 diabetes: a prospective cohort study
- - Mohamed Ghalwash
  - Jessica L Dunne
  - et al.
- 2022
- The Lancet Diabetes & Endocrinology
scQUEST: Quantifying tumor ecosystem heterogeneity from mass or flow cytometry data
- - Adriano Luca Martinelli
  - Johanna Wagner
  - et al.
- 2022
- STAR Protocols
Placement of Biological Membrane Patches in a Nanofluidic Gap With Control Over Position and Orientation
- - Francesca Ruggeri
  - Christian Schwemmer
  - et al.
- 2022
- Advanced Materials Interfaces