Compositional Communication with LLMs and Reasoning about Chemical StructuresDmitry ZubarevSarath Swaminathan2024NeurIPS 2024
Fine-Tuned MLP-Mixers as data-driven Numerical Surrogates?Imran NasimJoao Lucas de Sousa Almeida2024NeurIPS 2024
Learning to Optimize Molecules with a Chemical Language ModelJerret RossSamuel Hoffmanet al.2024NeurIPS 2024
A Large Encoder-Decoder Polymer-Based Foundation ModelEduardo Almeida SoaresNathaniel Parket al.2024NeurIPS 2024
Agnostic Causality-Driven Enhancement of Chemical Foundation Models on Downstream TasksVictor ShirasunaEduardo Almeida Soareset al.2024NeurIPS 2024
Towards Using Large Language Models and Deep Reinforcement Learning for Inertial Fusion EnergyVadim ElisseevMax Espositoet al.2024NeurIPS 2024
AIHWKIT-Lightning: A Scalable HW-Aware Training Toolkit for Analog In-Memory ComputingJulian BüchelWilliam Simonet al.2024NeurIPS 2024
SELF-BART : A Transformer-based Molecular Representation Model using SELFIESIndra Priyadarsini SSeiji Takedaet al.2024NeurIPS 2024
On the role of noise in factorizers for disentangling distributed representationsKumudu Geethan KarunaratneMichael Herscheet al.2024NeurIPS 2024