Physics-informed categorization of data modalities used in AI-assisted drug discovery
- 2025
- ACS Spring 2025
Talk
Publications
28 results at ACS Spring 2025
Natural Language-Driven Virtual Screening: Enhancing Drug Discovery with LLMs and Biomedical Foundation Models
- Tim Erdmann
- Holt Bui
- et al.
- 2025
- ACS Spring 2025
TalkNovel LLM-powered assistant facilitating data visualization in research and education
- Tim Erdmann
- Holt Bui
- et al.
- 2025
- ACS Spring 2025
TalkGMO-Mat: A foundation model-based generative multi-objective optimization framework for materials discovery
- Carlos Raoni De Alencar Mendes
- Leonardo Noia Nanci de Araujo Silva
- et al.
- 2025
- ACS Spring 2025
TalkOpen-source large-scale foundation model for chemistry
- Eduardo Almeida Soares
- Emilio Ashton Vital Brazil
- et al.
- 2025
- ACS Spring 2025
TalkAutomated tools for FAIRness assessment considering Chemical Digital Objects
- Leonardo Guerreiro Azevedo
- Viviane T. Silva
- et al.
- 2025
- ACS Spring 2025
TalkComparative Study of Open-source LLMs for text classification and knowledge extraction in the Material Discovery Domain
- Viviane T. Silva
- Anaximandro Souza
- et al.
- 2025
- ACS Spring 2025
TalkMol-Moe: A multi-view mixture-of-experts framework for molecular property prediction with SMILES, SELFIES, and graph representations
- Victor Yukio Shirasuna
- Emilio Ashton Vital Brazil
- et al.
- 2025
- ACS Spring 2025
TalkPFACTS: Faster solutions for forever chemicals
- Dan Sanders
- Brandi Ransom
- et al.
- 2025
- ACS Spring 2025
TalkChemChat | Democratizing Access to Domain-Specific AI/ML through LLM-powered Conversa-tional Assistants
- 2025
- ACS Spring 2025
Talk