Virtual screening refers to a range of “in-silico” techniques used to search large compound databases to select a smaller number of compounds for biological testing. Promising compounds are then “docked” to the protein or to the enzyme’s active site. Docking search algorithms generate “poses” (conformation, position and orientation) of the ligand within the active site, while scoring functions identify the most likely pose for an individual ligand and assign a priority order to a set of diverse ligands docked to the same protein, by estimate binding affinity. The aim of this book is to acquaint the reader with the possibilities of screening and docking of different ligands (drugs and pesticides) on the surface of different enzymes.
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Dr. Ferencz László is associate professor at Sapientia - Hungarian University of Transylvania, Faculty of Technical and Human Sciences, Târgu Mure¿. Mrs. Daniela-Lucia Muntean is professor and PhD doctor at the University of Medicine and Pharmacy from Târgu Mure¿, Faculty of Pharmacy.
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Taschenbuch. Zustand: Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -Virtual screening refers to a range of 'in-silico' techniques used to search large compound databases to select a smaller number of compounds for biological testing. Promising compounds are then 'docked' to the protein or to the enzyme's active site. Docking search algorithms generate 'poses' (conformation, position and orientation) of the ligand within the active site, while scoring functions identify the most likely pose for an individual ligand and assign a priority order to a set of diverse ligands docked to the same protein, by estimate binding affinity. The aim of this book is to acquaint the reader with the possibilities of screening and docking of different ligands (drugs and pesticides) on the surface of different enzymes. 72 pp. Englisch. Bestandsnummer des Verkäufers 9783659780431
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Taschenbuch. Zustand: Neu. nach der Bestellung gedruckt Neuware - Printed after ordering - Virtual screening refers to a range of 'in-silico' techniques used to search large compound databases to select a smaller number of compounds for biological testing. Promising compounds are then 'docked' to the protein or to the enzyme's active site. Docking search algorithms generate 'poses' (conformation, position and orientation) of the ligand within the active site, while scoring functions identify the most likely pose for an individual ligand and assign a priority order to a set of diverse ligands docked to the same protein, by estimate binding affinity. The aim of this book is to acquaint the reader with the possibilities of screening and docking of different ligands (drugs and pesticides) on the surface of different enzymes. Bestandsnummer des Verkäufers 9783659780431
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Taschenbuch. Zustand: Neu. This item is printed on demand - Print on Demand Titel. Neuware -Virtual screening refers to a range of 'in-silico' techniques used to search large compound databases to select a smaller number of compounds for biological testing. Promising compounds are then 'docked' to the protein or to the enzyme's active site. Docking search algorithms generate 'poses' (conformation, position and orientation) of the ligand within the active site, while scoring functions identify the most likely pose for an individual ligand and assign a priority order to a set of diverse ligands docked to the same protein, by estimate binding affinity. The aim of this book is to acquaint the reader with the possibilities of screening and docking of different ligands (drugs and pesticides) on the surface of different enzymes.VDM Verlag, Dudweiler Landstraße 99, 66123 Saarbrücken 72 pp. Englisch. Bestandsnummer des Verkäufers 9783659780431
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