Formulation Graphs for Mapping Structure-Composition of Battery Electrolytes to Device PerformanceVidushi SharmaMaxwell Giammonaet al.2023J. Chem. Inf. Model.
Synthesis Platforms for Generating High-Quality Polymer Datasets Utilizing Continuous and Discontinuous Reaction SetupsTim ErdmannNathaniel Parket al.2023ACS Fall 2023
Lab automation, data modeling, and AI agents for accelerated catalyst discoveryNathaniel ParkMatteo Manicaet al.2023ACS Fall 2023
An AI-assisted Workbench for Material DiscoveryEmilio Ashton Vital BrazilRenato Fontoura de Gusmao Cerqueiraet al.2023ACS Fall 2023
Accelerated Electrolyte Discovery using Data Driven ApproachVidushi SharmaMaxwell Giammonaet al.2023ACS Fall 2023
Integrating Chemical Language and Physicochemical Features for Enhanced Molecular Property Prediction with Multimodal Language ModelsEduardo Almeida SoaresEmilio Ashton Vital Brazilet al.2023KDD 2023
Human-AI Co-Creation Approach to Find Forever Chemicals ReplacementsJuliana Jansen FerreiraVinicius Seguraet al.2023CHI 2023
Ensemble Models for the Growth of Colloidal Sol-Gel MaterialsTim ErdmannJason Chenet al.2023MRS Spring Meeting 2023
Cost-Sensitive Bayesian Active Molecular Design with Auxiliary PropertiesElliot NelsonDmitry Zubarev2023MRS Spring Meeting 2023