Using QSAR Models to Predict Mitochondrial Targeting by Small-Molecule Xenobiotics Within Living Cells.
Sign Up to like & getrecommendations! Published in 2021 at "Methods in molecular biology"
DOI: 10.1007/978-1-0716-1262-0_1
Abstract: Prediction of mitochondrial targeting, or prediction of exclusion from mitochondria, of small-molecule xenobiotics (biocides, drugs, probes, toxins) can be achieved using an algorithm derived from QSAR modeling. Application of the algorithm requires knowing the chemical… read more here.
Keywords: qsar models; using qsar; small molecule; mitochondrial targeting ... See more keywords
Using 3D-QSAR and molecular docking insight into inhibitors binding with complex-associated kinases CDK8
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DOI: 10.1016/j.molstruc.2018.05.072
Abstract: Abstract As a kind of potential anticancer compounds, Cyclin-dependent kinase (CDK) inhibitors have receved great attention in recent years. In order to deep research the bioactivity and corresponding key influence factors of CDK8/19 inhibitors on… read more here.
Keywords: insight inhibitors; docking insight; qsar; using qsar ... See more keywords