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| Format: | Recurso digital |
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Zenodo
2026
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| Online Access: | https://doi.org/10.5281/zenodo.20236765 |
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| _version_ | 1866902161436180480 |
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| author | Mattelaer, Charles-Alexandre |
| author_facet | Mattelaer, Charles-Alexandre |
| contents | <p>raw data for https://github.com/camattelaer/pKa-calc_LFER</p> <p>BE AWARE this folder contains over 20GB of raw data from the calculations</p> |
| format | Recurso digital |
| id | zenodo_https___doi_org_10_5281_zenodo_20236765 |
| institution | Zenodo |
| language | |
| publishDate | 2026 |
| publisher | Zenodo |
| record_format | zenodo |
| spellingShingle | pKa ML correction model for QM direct pKa calculation Mattelaer, Charles-Alexandre <p>raw data for https://github.com/camattelaer/pKa-calc_LFER</p> <p>BE AWARE this folder contains over 20GB of raw data from the calculations</p> |
| title | pKa ML correction model for QM direct pKa calculation |
| url | https://doi.org/10.5281/zenodo.20236765 |