REPOSITORY QDB GUIDELINES CITING BLOG

Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for relative binding affinity to estrogen receptor. Q13-418a-0021. 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 relative binding affinity to estrogen receptor. Q13-418a-0021. Molcode Ltd., 2009.

QDB archive DOI: 10.15152/QDB.224   DOWNLOAD

QsarDB content

Property logER-RBA: Estrogen receptor binding in rat uterine cytosol [%]

QSAR: Model for estrogen receptor relative binding affinity

Regression model (regression)   QMRF

Open in:QDB Explorer QDB Predictor

Name Type n

R2

σ

Training set training 62 0.802 0.804
Test set external validation 6 0.711 0.665

Citing

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

  • Piir, G. QDB archive #224. QsarDB repository, 2020. http://dx.doi.org/10.15152/QDB.224

  • Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for relative binding affinity to estrogen receptor. Q13-418a-0021. Molcode Ltd., 2009.

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Title: Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for relative binding affinity to estrogen receptor. Q13-418a-0021. Molcode Ltd., 2009.
Abstract: This QSAR model corresponds to the QMRF Q13-418a-0021 "QSAR for relative binding affinity to estrogen receptor" from the JRC QSAR Model Database
URI: http://hdl.handle.net/10967/224
http://dx.doi.org/10.15152/QDB.224
Date: 2020-04-17


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