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Online Ressourcen
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

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