Age | Commit message (Collapse) | Author | |
---|---|---|---|
2017-08-04 | script to convert mol to mmol -log10 in training dataset | gebele | |
2016-11-24 | always convert to SMILESv9-nestec | gebele | |
2016-11-23 | added delog10;generalized mmol2-log10eNM | gebele | |
2016-05-12 | enm study import fixed | Christoph Helma | |
2016-05-09 | nanoparticle models fixed | Christoph Helma | |
2016-05-08 | default validations fixed | Christoph Helma | |
2016-05-07 | -log10 for regression datasets, test cleanups | Christoph Helma | |
2016-05-04 | first reasonable results for nanoparticle crossvalidation | Christoph Helma | |