May 20, 2011 · In this article, we compared the performance of several systematically developed QSAR models for CYP1A2 inhibition. We built the models with a ...
Jun 27, 2011 · Prediction of CYP450 inhibition activity of small molecules poses an important task due to high risk of drug-drug interactions.
This article compares 80 in-silico QSAR models that were created by following the same procedure with different combinations of descriptors and machine learning ...
Oct 17, 2011 · QSAR is based on the free energy relationship to equilibrium constants, which is proportional to the inverse of logarithm of inhibition ...
QSAR modeling of in vitro inhibition of cytochrome P450 3A4. J. Chem. Inf ... A comparison of different QSAR approaches to modeling CYP450 1A2 inhibition.
Sep 1, 2021 · Historically, several approaches have been proposed to calculate the applicability of a QSAR model ... Further, cytochrome P450 inhibition models ...
In this work, a model is presented for classification of CYP450 1A2 inhibitors ... , A comparison of different QSAR approaches to modeling CYP450 1A2 inhibition, ...
We compare the performance of QSAR model in three different scenarios. ... different QSAR approaches to modeling CYP450 1A2 inhibition. J. Chem. Inf ...
... (QSAR) Study of Flavonoid Derivatives for Inhibition of Cytochrome P450 1A2 ... A comparison of different QSAR approaches to modeling CYP450 1A2 inhibition.
... other methods have been compared [22–24]. Chohan et al. (2005) constructed QSAR models using four statistical approaches: partial least squares (PLS), MLR ...