Publications

3555 results for Materials Discovery

Hydrogen bond vs cationic activation: Exploring next generation design motifs for ROP organocatalysts
- - Jia Zhang
  - Caleb Jadrich
  - et al.
- 2023
- ACS Fall 2023
Talk
Interpretable latent representations for molecular property prediction models
- - Sanjoy Dey
  - Partha Suryanarayanan
  - et al.
- 2023
- ACS Fall 2023
Talk
Creating labs that learn through automated data management
- - Amol Thakkar
  - Andrea Giovannini
  - et al.
- 2023
- ACS Fall 2023
Talk
Topology-driven pre-training for robust molecular property prediction models
- - Aldo Guzmán-Sáenz
  - Sanjoy Dey
  - et al.
- 2023
- ACS Fall 2023
Talk
Synthesis Platforms for Generating High-Quality Polymer Datasets Utilizing Continuous and Discontinuous Reaction Setups
- - Tim Erdmann
  - Nathaniel Park
  - et al.
- 2023
- ACS Fall 2023
Talk
Knowledge extraction pipeline with foundation models for material discovery
- - Viviane T. Silva
  - Breno William Santos Rezende de Carvalho
  - et al.
- 2023
- ACS Fall 2023
Talk
Automatic structure elucidation from NMR spectra
- - Marvin Alberts
  - Federico Zipoli
  - et al.
- 2023
- ACS Fall 2023
Talk
Seeing the unseen: leveraging vision models to extract digital fingerprints of complex liquids
- - Gianmarco Gabrieli
  - Matteo Manica
  - et al.
- 2023
- ACS Fall 2023
Talk
AI-directed discovery of high entropy electrolyte formulations for batteries using interhalogen cathodes and lithium metal anodes
- - Maxwell Giammona
  - Vidushi Sharma
  - et al.
- 2023
- ACS Fall 2023
Talk
PatCID: Large-scale chemical-structure database from images in patent documents
- - Ingmar Meijer
  - Valery Weber
  - et al.
- 2023
- ACS Fall 2023
Talk