Publications

661 results for Generative AI

ChemChat | Democratizing Access to Domain-Specific AI/ML through LLM-powered Conversa-tional Assistants
- - Tim Erdmann
  - Stefan Zecevic
  - et al.
- 2025
- ACS Spring 2025
Talk
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
Aliphatic Polycarbonates: From Functional Platform Materials to Foundation Models
- - Nathaniel Park
  - James Hedrick
- 2025
- ACS Spring 2025
Talk
Generative AI and Multi-Agent Systems for Polymer Design
- - Nathaniel Park
  - Tiffany Callahan
  - et al.
- 2025
- ACS Spring 2025
Talk
Foundation models for materials discovery – current state and future directions
- - Edward O. Pyzer-Knapp
  - Matteo Manica
  - et al.
- 2025
- npj Computational Materials
Review
Preparing Good Data for Generative AI: Challenges and Approaches (Good-Data)
- - David Vazquez
  - Laure Berti-equille
  - et al.
- 2025
- AAAI 2025
Workshop
CyberPal.AI: Empowering LLMs with Expert-Driven Cybersecurity Instructions
- - Matan Levi
  - Yair Allouche
  - et al.
- 2025
- AAAI 2025
Poster
From PEFT to DEFT: Parameter Efficient Finetuning for Reducing Activation Density in Transformers
- - Bharat Runwal
  - Tejaswini Pedapati
  - et al.
- 2025
- AAAI 2025
Poster
Question-guided Insights Generation for Automated Exploratory Data Analysis
- - Abhijit Manatkar
  - Akella Ashlesha
  - et al.
- 2025
- AAAI 2025
Demo paper
Agentic AI for Digital Twin
- - Alexander Timms
  - Abigail Langbridge
  - et al.
- 2025
- AAAI 2025
Demo paper