Development of Ensemble Models for the Growth of Colloidal Spin-on-Glass MaterialsTim ErdmannSarath Swaminathanet al.2022ACS Fall 2022Talk
A system for understanding molecular formula patterns for non-stoichiometric, variable inorganic compoundsTom GriffinKristin Schmidt2022ACS Fall 2022Invited talk
Combining high-quality, humanly curated data with language models: the dawn of on-demand machine learning models for digital chemistryAlain VaucherFiona Shortt de Hernandezet al.2022ACS Fall 2022Conference paper
Universal reagents for CO2 capture, storage, and upcycling into value-added polymerDino WuNathaniel Parket al.2022ACS Fall 2022Conference paper
Neuro-symbolic reinforcement learning for polymer discoverySarath SwaminathanDmitry Zubarev2022ACS Fall 2022Conference paper
Carbon dioxide sourced functional cyclic carbonates used to prepare macromolecular therapeutics to treat infectious disease and cancerJames Hedrick2022ACS Fall 2022Conference paper
Accelerating Material Design with the Generative Toolkit for Scientific Discovery (GT4SD)Matteo ManicaJoris Cadowet al.2022ACS Fall 2022Conference paper
Deep learning assisted Suzuki cross coupling catalyst designOliver SchilterFederico Zipoliet al.2022ACS Fall 2022Conference paper
Combining physics-based modeling and graph neural networks for drug discoveryJoseph Morrone2022ACS Fall 2022Conference paper
Oxidizing gas enhancement of lithium-iodine batteries: Towards practical iodine cathodes and viable lithium metal protection strategiesMaxwell GiammonaLinda Sundberget al.2022ACS Fall 2022Conference paper