Published July 8, 2024
| Version v1
Dataset
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Artificial Metalloenzyme-Catalyzed Enantioselective Carboamination of Alkenes
Description
Data underlying the figures/tables in the publication "Artificial Metalloenzyme-Catalyzed Enantioselective Carboamination of Alkenes" published in ChemCatChem doi.org/10.1002/cctc.202400365
The files correspond to the figures in the publication as follows:
Fig 1a, Table S2 -> MODDE_test/DoE_Rh.*
Fig 1b, Table S3 -> Measurement_1st_neutral.xlsx
Fig 3, Table S4 -> Measurement_2nd_AcOH.xlsx
DoE program and results -> DoE_program/DoE_byGaussianOptimization.ipynb, DoE_Exp_Table_1st_neutral.csv, DoE_Exp_Table_2nd_AcOH.csv
Files
Zenodo_upload_ChemCatChem.zip
Files
(1.7 MB)
| Name | Size | Download all |
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md5:3e88777213136b5f99b7b90b580c6604
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1.7 MB | Preview Download |
Additional details
Related works
- Cites
- Journal article: 10.1002/cctc.202400365 (DOI)
- Is supplemented by
- Dataset: 10.2210/pdb8OJX/pdb (DOI)
- Dataset: 10.2210/pdb8OJW/pdb (DOI)
Funding
- NCCR Catalysis (phase I) 180544
- Swiss National Science Foundation
- NCCR MSE: Molecular Systems Engineering (phase III) 205608
- Swiss National Science Foundation