Publications

553 results for Accelerated Discovery

Unraveling Molecular Structure: A Multimodal Spectroscopic Dataset for Chemistry
- - Marvin Alberts
  - Oliver Schilter
  - et al.
- 2024
- NeurIPS 2024
Symmetry-Informed Governing Equation Discovery
- - Jianke Yang
  - Wang Rao
  - et al.
- 2024
- NeurIPS 2024
Enhancing Reasoning to Adapt Large Language Models for Domain-Specific Applications
- - Bo Wen
  - Xin Zhang
- 2024
- NeurIPS 2024
A Mamba-Based Foundation Model for Chemistry
- 2024
- NeurIPS 2024
Improving Structural Plausibility in 3D Molecule Generation via Property-Conditioned Training with Distorted Molecules
- - Lucy Vost
  - Vijil Vijil
  - et al.
- 2024
- NeurIPS 2024
Learning to Optimize Molecules with a Chemical Language Model
- - Jerret Ross
  - Samuel Hoffman
  - et al.
- 2024
- NeurIPS 2024
Towards Using Large Language Models and Deep Reinforcement Learning for Inertial Fusion Energy
- - Vadim Elisseev
  - Max Esposito
  - et al.
- 2024
- NeurIPS 2024
Unified Lookup Tables: Privacy-Preserving Foundation Models
- - Nikita Janakarajan
  - Irina Espejo Morales
  - et al.
- 2024
- NeurIPS 2024
SELF-BART : A Transformer-based Molecular Representation Model using SELFIES
- - Indra Priyadarsini S
  - Seiji Takeda
  - et al.
- 2024
- NeurIPS 2024
Regress, Don’t Guess – A Regression-like Loss on Number Tokens for Language Models
- - Jonas Zausinger
  - Lars Pennig
  - et al.
- 2024
- NeurIPS 2024