bindesh kumar shukla (9 résultats)

Etat : New.

Taschenbuch. Etat : Neu. Molecular Modeling Investigations on Pyrazolo[3,4-d]pyrimidines | Bindesh Kumar Shukla (u. a.) | Taschenbuch | 244 S. | Englisch | 2019 | LAP LAMBERT Academic Publishing | EAN 9786202075473 | Verantwortliche Person für die EU: BoD - Books on Demand, In de Tarpen 42, 22848 Norderstedt, info[at]bod[dot]de | Anbieter: preigu.

Taschenbuch. Etat : Neu. Neuware -The present edition of the book targets a broad readership for young researchers(Postgraduate students) in the area of Quantum Chemistry and molecular modeling as it contains a wide and comprehensive coverage of all important aspects of the subject including up-to- date survey of recent revolutionary advances. Starting from the optimization of the molecules in vacuum, calculation of their electronic properties, preparation of these molecules(ligands) and targets, generation of electron affinity maps, and docking of prepared ligands within active site of the targets have been presented. In addition, the molecular dynamics simulation of the docked complexes and binding free energies of ligands, in order to study the time dependent behaviour and strength of binding, have also been offered. Pyrazolo[3,4-d]pyrimidines, possessing various pharmaceutical activities, have been taken as an example and their inhibitory mechanism and strength of binding with suitable targets have been discussed in order to develop effective drugs against amoebiasis and tuberculosis. The modeling investigations on pyrazolo[3,4-d]pyrimidines will be very beneficial in the area of rational drug designing.Books on Demand GmbH, Überseering 33, 22297 Hamburg 244 pp. Englisch.

Paperback. Etat : Brand New. 244 pages. 8.66x5.91x0.55 inches. In Stock.

Taschenbuch. Etat : Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -The present edition of the book targets a broad readership for young researchers(Postgraduate students) in the area of Quantum Chemistry and molecular modeling as it contains a wide and comprehensive coverage of all important aspects of the subject including up-to- date survey of recent revolutionary advances. Starting from the optimization of the molecules in vacuum, calculation of their electronic properties, preparation of these molecules(ligands) and targets, generation of electron affinity maps, and docking of prepared ligands within active site of the targets have been presented. In addition, the molecular dynamics simulation of the docked complexes and binding free energies of ligands, in order to study the time dependent behaviour and strength of binding, have also been offered. Pyrazolo[3,4-d]pyrimidines, possessing various pharmaceutical activities, have been taken as an example and their inhibitory mechanism and strength of binding with suitable targets have been discussed in order to develop effective drugs against amoebiasis and tuberculosis. The modeling investigations on pyrazolo[3,4-d]pyrimidines will be very beneficial in the area of rational drug designing. 244 pp. Englisch.

Etat : New. Dieser Artikel ist ein Print on Demand Artikel und wird nach Ihrer Bestellung fuer Sie gedruckt. Autor/Autorin: Shukla Bindesh KumarDr. B. K. Shukla obtained his Ph.D. in Physics from D.D.U. Gorakhpur University, Gorakhpur. Prof. Umesh Yadava,started his career as Lecturer at MGPG College, Gorakhpur in 2001.He joined Department of Physics, DDU.

Etat : New. Print on Demand.

Etat : New. PRINT ON DEMAND.

Taschenbuch. Etat : Neu. nach der Bestellung gedruckt Neuware - Printed after ordering - The present edition of the book targets a broad readership for young researchers(Postgraduate students) in the area of Quantum Chemistry and molecular modeling as it contains a wide and comprehensive coverage of all important aspects of the subject including up-to- date survey of recent revolutionary advances. Starting from the optimization of the molecules in vacuum, calculation of their electronic properties, preparation of these molecules(ligands) and targets, generation of electron affinity maps, and docking of prepared ligands within active site of the targets have been presented. In addition, the molecular dynamics simulation of the docked complexes and binding free energies of ligands, in order to study the time dependent behaviour and strength of binding, have also been offered. Pyrazolo[3,4-d]pyrimidines, possessing various pharmaceutical activities, have been taken as an example and their inhibitory mechanism and strength of binding with suitable targets have been discussed in order to develop effective drugs against amoebiasis and tuberculosis. The modeling investigations on pyrazolo[3,4-d]pyrimidines will be very beneficial in the area of rational drug designing.