There is a newer version of the record available.

Published June 12, 2024 | Version v1
Dataset Open

Unraveling Molecular Structure: A Multimodal Spectroscopic Dataset for Chemistry

Creators

  • 1. ROR icon IBM Research - Zurich
  • 2. ROR icon University of Zurich
  • 3. ROR icon École Polytechnique Fédérale de Lausanne

Description

This repository contains the data associated with: "Unraveling Molecular Structure: A Multimodal Spectroscopic Dataset for Chemistry" (see here: https://rxn4chemistry.github.io/multimodal-spectroscopic-dataset/)

Files

multimodal_spectroscopic_dataset.zip

Files (10.4 GB)

Name Size Download all
md5:ebe80287ca9a7a8944e0c4ea1f12df50
10.4 GB Preview Download

Additional details

Related works

Is part of
https://rxn4chemistry.github.io/multimodal-spectroscopic-dataset/ (URL)

Funding

Swiss National Science Foundation
NCCR Catalysis (phase I) 51NF40_180544

Dates

Available
2024-06-12

Software

Repository URL
https://github.com/rxn4chemistry/multimodal-spectroscopic-dataset