Published June 12, 2024
| Version v1
Dataset
Open
Data Set for the Journal Article "Heron: Visualizing and Controlling Chemical Reaction Explorations and Networks"
Creators
- 1. Department of Chemistry and Applied Biosciences, ETH Zurich
Description
This data archive contains all data newly created in the following publication:
Charlotte H. Müller, Miguel Steiner, Jan P. Unsleber, Thomas Weymuth, Moritz Bensberg, Katja-
Sophia Csizi, Maximilian Mörchen, Paul L. Türtscher, and Markus Reiher, "Heron: Visualizing and
Controlling Chemical Reaction Explorations and Networks", in preparation.
The directory contents are as follows:
- steered_eschenmoser.tar.xz: Dump of the database created during the steered exploration
- steered_exploration_protocol_chemoton_3.1.json: Protocol used for the steered exploration
Files
steered_exploration_protocol_chemoton_3.1.json
Files
(1.1 GB)
| Name | Size | Download all |
|---|---|---|
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md5:44f5db89e80f159043aec85e6c9986ce
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1.1 GB | Download |
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md5:8227da8e6e2cec9a549ac0af0180c66f
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1.6 MB | Preview Download |