Publications

1650 results for Machine Learning

Molecular Modelling in Bioactive Peptide Discovery and Characterisation
- - Clement Agoni
  - Raúl Fernández Díaz
  - et al.
- 2025
- Molecules
Review
A new framework for evaluating machine learning in biochemistry and its application for small molecules and peptides
- - Raúl Fernández Díaz
  - Lam Thanh Hoang
  - et al.
- 2025
- IRB-AI-DD 2025
Poster
Serving LLMs as detectors in workflows with guardrails
- - Gaurav Kumbhat
  - Evaline Ju
- 2025
- ICSA 2025
Workshop paper
New Loss Function for Learning Dielectric Thickness Distributions and Generative Modeling of Breakdown Lifetime
- - Weiman Yan
  - Ernest Wu
  - et al.
- 2025
- IRPS 2025
Conference paper
On Representations of Mean-Field Variational Inference
- - Soumyadip Ghosh
  - Yingdong Lu
  - et al.
- 2025
- Journal of Applied Analysis
Paper
PowerSoftmax: Towards secure LLM Inference Over FHE
- - Itamar Zimerman
  - Allon Adir
  - et al.
- 2025
- FHE.org 2025
Poster
Natural Language-Driven Virtual Screening: Enhancing Drug Discovery with LLMs and Biomedical Foundation Models
- - Tim Erdmann
  - Holt Bui
  - et al.
- 2025
- ACS Spring 2025
Talk
Extracting Electrolyte Design from Interpretable Data-Driven Methods
- - Vidushi Sharma
  - Maxwell Giammona
  - et al.
- 2025
- ACS Spring 2025
Talk
ML-Guided Engineering to Enhance Cell-Organelle Capacity for Multi-Enzyme Pathway Compartmentalization
- - Jie Shi
  - Jordan Baker
  - et al.
- 2025
- ACS Spring 2025
Talk
Novel LLM-powered assistant facilitating data visualization in research and education
- - Tim Erdmann
  - Holt Bui
  - et al.
- 2025
- ACS Spring 2025
Talk