Publications

This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.

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49 results for Dmitry Zubarev

Compositional Communication with LLMs and Reasoning about Chemical Structures
- - Dmitry Zubarev
  - Sarath Swaminathan
- 2024
- NeurIPS 2024
Automating and Accelerating Scientific Discovery – Continuous and Discontinuous Experimentation Setups for Polymer Research and High-Quality Dataset Generation
- - Tim Erdmann
  - Nathaniel Park
  - et al.
- 2023
- MaRDA 2023
ChemChat | Conversational Expert Assistant in Material Science and Data Visualization
- - Tim Erdmann
  - Stefan Zecevic
  - et al.
- 2024
- Humboldt Colloquium US 2024
Transfer Learning Enabled Deep Learning Model for the Prediction of Battery Performance from Electrolyte Formulations
- - Vidushi Sharma
  - Maxwell Giammona
  - et al.
- 2022
- ECS Meeting 2022
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
Chemical Space Analysis and Property Prediction for Carbon Capture Amine molecules
- - James Mcdonagh
  - Stamatia Zavitsanou
  - et al.
- 2024
- Digital Discovery
Formulation Graphs for Mapping Structure-Composition of Battery Electrolytes to Device Performance
- - Vidushi Sharma
  - Maxwell Giammona
  - et al.
- 2023
- J. Chem. Inf. Model.
Chemical space analysis and property prediction for carbon capture amine molecules
- - James McDonagh
  - Stamatia Zavitsanou
  - et al.
- 2022
- ChemRxiv