Molecular diffusion enhanced performance evaluation of metal-organic frameworks for CO2 capture
- Rodrigo Neumann Barros Ferreira
- Yogesh Joshi
- et al.
- 2025
- ACS Fall 2025
Publications
1505 results for Machine Learning
AI-driven prediction of monoclonal antibody binding and activity against influenza A virus
- Michal Ozery-Flato
- Ella Barkan
- et al.
- 2025
- ACS Fall 2025
Transformer Model for Structure Elucidation from Tandem Mass Spectroscopy data
- Laura Mismetti
- Marvin Alberts
- et al.
- 2025
- ACS Fall 2025
How to generalize machine learning models to both canonical and non-canonical peptides
- Raúl Fernández Díaz
- Rodrigo Ochoa
- et al.
- 2025
- ACS Fall 2025
Hybrid quantum-classical simulation of periodic materials
- Rodrigo Neumann Barros Ferreira
- Alan Duriez
- et al.
- 2025
- ACS Fall 2025
Deep Learning for Graph Anomaly Detection
- Hezhe Qiao
- Hanghang Tong
- et al.
- 2025
- IJCAI 2025
Understanding and Tackling Over-Dilution in Graph Neural Networks
- Junhyun Lee
- Veronika Thost
- et al.
- 2025
- KDD 2025
When Heterophily Meets Heterogeneity: Challenges and a New Large-Scale Graph Benchmark
- Lin Junhong
- Xiaojie Guo
- et al.
- 2025
- KDD 2025
Learnable Channel Converter for Multi-Spectral Image to RGB Visualization using a Vision-Text Model
- Haoxiang Qiu
- Tomoya Sakai
- et al.
- 2025
- IGARSS 2025
Fine-tuning for Extreme Event Prediction: Are Ensemble Methods All You Need?
- 2025
- KDD 2025