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In Silico Modeling and its Applications on Biomolecules: Computational Studies on Cholinesterase and Other Medicinally Important Enzymes - Softcover
Synopsis
The book provides a general introduction to advanced computational techniques applied in various stages of drug discovery. In particular, it focuses on molecular modeling, ligand- and structure-based drug design methods, and data mining in chemical informatics. Application side of this book deals with the development of the first structure-based three-dimensional quantitative structure-activity relationship (3D-QSAR) model of butyrylcholinesterase - a putative drug target for the treatment of Alzheimer's disease. The other part is comprised of detailed work conducted on 5-HT2C agonists. It describes pharmacophore modeling and 3D-QSAR studies. Comparative Molecular Field Analysis coupled with a genetic algorithm (CoMFA-GA) was carried out for aligned ligands. The last part describes the drug target MTB-Thymidine monophosphate kinase (TMPKMtub). The molecular modeling analyses resulted in identification of a cluster of water molecules that mediate key interactions between bound ligands and backbone atoms of the enzyme residues.
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About the Authors
Reaz Uddin holds a PhD degree in the field of computational medicinal chemistry. Currently he is working as junior faculty at Dr. Panjwani Center for Molecular Medicine, ICCBS, University of Karachi. His particular area of interest includes the use of computational biology methods to understand complex biological phenomena.
Reaz Uddin holds a PhD degree in the field of computational medicinal chemistry. Currently he is working as junior faculty at Dr. Panjwani Center for Molecular Medicine, ICCBS, University of Karachi. His particular area of interest includes the use of computational biology methods to understand complex biological phenomena.
Reaz Uddin holds a PhD degree in the field of computational medicinal chemistry. Currently he is working as junior faculty at Dr. Panjwani Center for Molecular Medicine, ICCBS, University of Karachi. His particular area of interest includes the use of computational biology methods to understand complex biological phenomena.
"About this title" may belong to another edition of this title.
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In Silico Modeling and its Applications on Biomolecules
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LAP LAMBERT Academic Publishing Apr 2011, 2011
ISBN 10: 3844328238
ISBN 13: 9783844328233
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Seller: BuchWeltWeit Ludwig Meier e.K., Bergisch Gladbach, Germany
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Taschenbuch. Condition: Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -The book provides a general introduction to advanced computational techniques applied in various stages of drug discovery. In particular, it focuses on molecular modeling, ligand- and structure-based drug design methods, and data mining in chemical informatics. Application side of this book deals with the development of the first structure-based three-dimensional quantitative structure-activity relationship (3D-QSAR) model of butyrylcholinesterase - a putative drug target for the treatment of Alzheimer's disease. The other part is comprised of detailed work conducted on 5-HT2C agonists. It describes pharmacophore modeling and 3D-QSAR studies. Comparative Molecular Field Analysis coupled with a genetic algorithm (CoMFA-GA) was carried out for aligned ligands. The last part describes the drug target MTB-Thymidine monophosphate kinase (TMPKMtub). The molecular modeling analyses resulted in identification of a cluster of water molecules that mediate key interactions between bound ligands and backbone atoms of the enzyme residues. 188 pp. Englisch. Seller Inventory # 9783844328233
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In Silico Modeling and its Applications on Biomolecules
Published by
LAP LAMBERT Academic Publishing, 2011
ISBN 10: 3844328238
ISBN 13: 9783844328233
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Condition: New. Dieser Artikel ist ein Print on Demand Artikel und wird nach Ihrer Bestellung fuer Sie gedruckt. Autor/Autorin: Uddin ReazReaz Uddin holds a PhD degree in the field of computational medicinal chemistry. Currently he is working as junior faculty at Dr. Panjwani Center for Molecular Medicine, ICCBS, University of Karachi. His particular area of . Seller Inventory # 5473223
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In Silico Modeling and its Applications on Biomolecules : Computational Studies on Cholinesterase and Other Medicinally Important Enzymes
Published by
LAP LAMBERT Academic Publishing, 2011
ISBN 10: 3844328238
ISBN 13: 9783844328233
New
Taschenbuch
Seller: AHA-BUCH GmbH, Einbeck, Germany
Seller rating 5 out of 5 stars
Taschenbuch. Condition: Neu. nach der Bestellung gedruckt Neuware - Printed after ordering - The book provides a general introduction to advanced computational techniques applied in various stages of drug discovery. In particular, it focuses on molecular modeling, ligand- and structure-based drug design methods, and data mining in chemical informatics. Application side of this book deals with the development of the first structure-based three-dimensional quantitative structure-activity relationship (3D-QSAR) model of butyrylcholinesterase - a putative drug target for the treatment of Alzheimer's disease. The other part is comprised of detailed work conducted on 5-HT2C agonists. It describes pharmacophore modeling and 3D-QSAR studies. Comparative Molecular Field Analysis coupled with a genetic algorithm (CoMFA-GA) was carried out for aligned ligands. The last part describes the drug target MTB-Thymidine monophosphate kinase (TMPKMtub). The molecular modeling analyses resulted in identification of a cluster of water molecules that mediate key interactions between bound ligands and backbone atoms of the enzyme residues. Seller Inventory # 9783844328233
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In Silico Modeling and its Applications on Biomolecules | Computational Studies on Cholinesterase and Other Medicinally Important Enzymes
Published by
LAP LAMBERT Academic Publishing, 2011
ISBN 10: 3844328238
ISBN 13: 9783844328233
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Taschenbuch
Seller: preigu, Osnabrück, Germany
Seller rating 5 out of 5 stars
Taschenbuch. Condition: Neu. In Silico Modeling and its Applications on Biomolecules | Computational Studies on Cholinesterase and Other Medicinally Important Enzymes | Reaz Uddin (u. a.) | Taschenbuch | 188 S. | Englisch | 2011 | LAP LAMBERT Academic Publishing | EAN 9783844328233 | Verantwortliche Person für die EU: preigu GmbH & Co. KG, Lengericher Landstr. 19, 49078 Osnabrück, mail[at]preigu[dot]de | Anbieter: preigu. Seller Inventory # 107031449
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In Silico Modeling and its Applications on Biomolecules
Published by
LAP LAMBERT Academic Publishing Apr 2011, 2011
ISBN 10: 3844328238
ISBN 13: 9783844328233
New
Taschenbuch
Seller: buchversandmimpf2000, Emtmannsberg, BAYE, Germany
Seller rating 5 out of 5 stars
Taschenbuch. Condition: Neu. This item is printed on demand - Print on Demand Titel. Neuware -The book provides a general introduction to advanced computational techniques applied in various stages of drug discovery. In particular, it focuses on molecular modeling, ligand- and structure-based drug design methods, and data mining in chemical informatics. Application side of this book deals with the development of the first structure-based three-dimensional quantitative structure-activity relationship (3D-QSAR) model of butyrylcholinesterase - a putative drug target for the treatment of Alzheimer's disease. The other part is comprised of detailed work conducted on 5-HT2C agonists. It describes pharmacophore modeling and 3D-QSAR studies. Comparative Molecular Field Analysis coupled with a genetic algorithm (CoMFA-GA) was carried out for aligned ligands. The last part describes the drug target MTB-Thymidine monophosphate kinase (TMPKMtub). The molecular modeling analyses resulted in identification of a cluster of water molecules that mediate key interactions between bound ligands and backbone atoms of the enzyme residues.VDM Verlag, Dudweiler Landstraße 99, 66123 Saarbrücken 188 pp. Englisch. Seller Inventory # 9783844328233