Publications

58 results for Dmitry Zubarev

A Framework for Toxic PFAS Replacement based on GFlowNet and Chemical Foundation Model
- - Eduardo Almeida Soares
  - Flaviu Cipcigan
  - et al.
- 2023
- NeurIPS 2023
Formulation Graphs for Mapping Structure-Composition of Battery Electrolytes to Device Performance
- - Vidushi Sharma
  - Maxwell Giammona
  - et al.
- 2023
- J. Chem. Inf. Model.
Designing an AI assistant for chemical discovery
- - Siya Kunde
  - Stephanie Houde
  - et al.
- 2023
- ACS Fall 2023
An AI-assisted Workbench for Material Discovery
- - Emilio Ashton Vital Brazil
  - Renato Fontoura de Gusmao Cerqueira
  - et al.
- 2023
- ACS Fall 2023
Lab automation, data modeling, and AI agents for accelerated catalyst discovery
- - Nathaniel Park
  - Matteo Manica
  - et al.
- 2023
- ACS Fall 2023
Synthesis Platforms for Generating High-Quality Polymer Datasets Utilizing Continuous and Discontinuous Reaction Setups
- - Tim Erdmann
  - Nathaniel Park
  - et al.
- 2023
- ACS Fall 2023
Accelerated Electrolyte Discovery using Data Driven Approach
- - Vidushi Sharma
  - Maxwell Giammona
  - et al.
- 2023
- ACS Fall 2023
Integrating Chemical Language and Physicochemical Features for Enhanced Molecular Property Prediction with Multimodal Language Models
- 2023
- KDD 2023
Human-AI Co-Creation Approach to Find Forever Chemicals Replacements
- - Juliana Jansen Ferreira
  - Vinicius Segura
  - et al.
- 2023
- CHI 2023
Cost-Sensitive Bayesian Active Molecular Design with Auxiliary Properties
- - Elliot Nelson
  - Dmitry Zubarev
- 2023
- MRS Spring Meeting 2023