Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for algae toxicity of benzene derivatives. Q13-32-0028. Molcode Ltd., 2009.

QsarDB Repository

Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for algae toxicity of benzene derivatives. Q13-32-0028. Molcode Ltd., 2009.

QDB archive DOI: 10.15152/QDB.222   DOWNLOAD

QsarDB content

Property pEC50: Algal toxicity as log(1/EC50) [mM]

QSAR: Model for algal toxicity

Regression model (regression)   QMRF

Open in:QDB ExplorerQDB Predictor

NameTypen

R2

σ
Training settraining730.9210.415
Test setexternal validation180.8870.501

Citing

When using this QDB archive, please cite (see details) it together with the original article:

  • Piir, G. Data for: QSAR for algae toxicity of benzene derivatives. QsarDB repository, QDB.222. 2020. https://doi.org/10.15152/QDB.222

  • Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for algae toxicity of benzene derivatives. Q13-32-0028. Molcode Ltd., 2009.

Metadata

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dc.date.accessioned2020-04-17T09:37:32Z
dc.date.available2020-04-17T09:37:32Z
dc.date.issued2020-04-17
dc.identifier.urihttp://hdl.handle.net/10967/222
dc.identifier.urihttp://dx.doi.org/10.15152/QDB.222
dc.description.abstractThis QSAR model corresponds to the QMRF Q13-32-0028 "QSAR for algae toxicity of benzene derivatives" from the JRC QSAR Model Database
dc.publisherGeven Piir
dc.rightsAttribution 4.0 International*
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/*
dc.titleTulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for algae toxicity of benzene derivatives. Q13-32-0028. Molcode Ltd., 2009.
qdb.property.endpoint3. Ecotoxic effects 3.2. Short-term toxicity to algaeen_US
qdb.property.speciesChlorella vulgarisen_US
qdb.descriptor.applicationQSARModel 4.0.3en_US
qdb.prediction.applicationQSARModel 4.0.3en_US
bibtex.entrytechreporten_US
bibtex.entry.authorTulp, I.
bibtex.entry.authorTamm, T.
bibtex.entry.authorKarelson, G.
bibtex.entry.authorDobchev, D.
bibtex.entry.authorMartin, D.
bibtex.entry.authorTämm, K.
bibtex.entry.authorSavchenko, D.
bibtex.entry.authorJänes, J.
bibtex.entry.authorHärk, E.
bibtex.entry.authorKreegipuu, A.
bibtex.entry.authorKarelson, M.
bibtex.entry.institutionMolcode Ltd.en_US
bibtex.entry.numberQ13-32-0028en_US
bibtex.entry.titleQSAR for algae toxicity of benzene derivativesen_US
bibtex.entry.year2009
qdb.model.typeRegression model (regression)en_US
qdb.model.qmrfQSAR=Q13-32-0028en_US


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