A system for understanding molecular formula patterns for non-stoichiometric, variable inorganic compoundsTom GriffinKristin Schmidt2022ACS Fall 2022
Learning End-to-End Goal-Oriented Dialog with Maximal User Task Success and Minimal Human Agent UseJanarthanan RajendranJatin Ganhotraet al.2019ACL 2019
Dataset of Reticular Materials' Syntheses Automatically Created from PDFs by using LLMsViviane T. SilvaRodrigo Neumann Barros Ferreiraet al.2024ACS Fall 2024
Multimodal Transformer models for Structure Elucidation from SpectraMarvin AlbertsAlain Vaucher2024ACS Spring 2024
Lessons learned in Knowledge Extraction from Unstructured Data with LLMs for Material DiscoveryViviane T. SilvaJoão Pedro Gandarela de Souzaet al.2024ACS Spring 2024
Unifying Molecular and Textual Representations via Multi-task Language ModellingDimitrios ChristofidellisGiorgio Giannoneet al.2023MRS Spring Meeting 2023
Enzyme optimization via a generative language modeling-based evolutionary algorithmYves Gaetan Nana TeukamFrancesca Grisoniet al.2023ACS Spring 2023
Unifying Molecular and Textual Representations via Multi-task Language ModellingDimitrios ChristofidellisGiorgio Giannoneet al.2023ACS Spring 2023