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| Link zu diesem Datensatz | https://d-nb.info/1378794869 |
| Titel | Docking Screens for Drug Discovery / edited by Walter Filgueira de Azevedo Jr |
| Person(en) | de Azevedo Jr., Walter Filgueira (Herausgeber) |
| Organisation(en) | SpringerLink (Online service) (Sonstige) |
| Ausgabe | 2nd ed. 2026 |
| Verlag | New York, NY : Springer US, Imprint: Humana |
| Zeitliche Einordnung | Erscheinungsdatum: 2026 |
| Umfang/Format | Online-Ressource, XIV, 314 p. 87 illus., 83 illus. in color. : online resource. |
| Andere Ausgabe(n) |
Printed edition:: ISBN: 978-1-0716-4948-0 Printed edition:: ISBN: 978-1-0716-4950-3 Printed edition:: ISBN: 978-1-0716-4951-0 |
| Inhalt | A Primer of SanDReS 2.0 for Scoring Function Design -- Exploring the Scoring Function Space with Lasso Regression -- Combining MVD and Ridge Method to Predict CDK2 Inhibition -- Elastic Net Regression to Predict CDK2 Inhibition -- Gradient Descent to Predict Enzyme Inhibition -- Decision Tree for Prediction of Binding Affinity -- Calculating Enzyme Inhibition with Random Forests -- Extremely Randomized Trees to Determine Binding Affinity -- Hands-On Docking with Molegro Virtual Docker -- Molegro Virtual Docker for Docking Screens -- Molegro Data Modeller for Machine Learning -- Neural Networks with Molegro Data Modeller -- AlphaFold for Docking Screens -- Differential Evolution for Docking Simulations -- Machine Learning to Predict CDK4 Inhibition -- Targeting CDK9 with Molegro Virtual Docker -- CDK7 as a Target for Docking Screens -- Molegro Data Modeller to Estimate CDK6 Inhibition -- Neural Networks to Calculate CDK2 Inhibition -- Tree-Based Methods to Predict Enzyme Inhibition |
| Persistent Identifier |
URN: urn:nbn:de:101:1-2510130410566.712987603196 DOI: 10.1007/978-1-0716-4949-7 |
| URL | https://doi.org/10.1007/978-1-0716-4949-7 |
| ISBN/Einband/Preis | 978-1-0716-4949-7 |
| Sprache(n) | Englisch (eng) |
| Beziehungen | Methods in Molecular Biology ; 2984 |
| Sachgruppe(n) | 610 Medizin, Gesundheit |
| Online-Zugriff | Archivobjekt öffnen |
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