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Quantum Chemical Reactivity Descriptors in Computational Drug Design - Nazmul Islam
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Quantum Chemical Reactivity Descriptors in Computational Drug Design - neues Buch

ISBN: 9783838372655

The fundamental idea of chemistry is that the physical and chemical properties of molecules are determined in terms of their topological and electronic structures. It is widely accepted that the structural formula of an organic compound contains all its chemical,biological and physical properties coded in it.The drug- bacteria interaction is nothing but simply a chemical process. Many drug active molecules act by binding specifically and all of the sites of a molecule are not active. Drug- bacteria interaction takes place not globally but locally.The QSAR and QSPR are the attempts to correlate structural or property descriptors of compounds with some of their specific biological activity in terms of some mathematical formulations.In this works, within the paradigm of QSAR/QSPR and using global and local reactivity descriptors of DFT and MO theory we have found a nice correlation between theoretically computed and experimentally determined drug activities. Textbooks New Books ~~ Science~~ Chemistry ~~ Physical & Theoretical Quantum-Chemical-Reactivity-Descriptors-in-Computational-Drug-Design~~Nazmul-Islam AV Akademikerverlag GmbH & Co. KG. The fundamental idea of chemistry is that the physical and chemical properties of molecules are determined in terms of their topological and electronic structures. It is widely accepted that the structural formula of an organic compound contains all its chemical,biological and physical properties coded in it.The drug- bacteria interaction is nothing but simply a chemical process. Many drug active molecules act by binding specifically and all of the sites of a molecule are not active. Drug- bacteria interaction takes place not globally but locally.The QSAR and QSPR are the attempts to correlate structural or property descriptors of compounds with some of their specific biological activity in terms of some mathematical formulations.In this works, within the paradigm of QSAR/QSPR and using global and local reactivity descriptors of DFT and MO theory we have found a nice correlation between theoretically computed and experimentally determined drug activities.

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Quantum Chemical Reactivity Descriptors in Computational Drug Design: On the Applicability of the Quantum Chemical Reactivity Descriptors in Computational Drug Design - Nazmul Islam
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Quantum Chemical Reactivity Descriptors in Computational Drug Design: On the Applicability of the Quantum Chemical Reactivity Descriptors in Computational Drug Design - Taschenbuch

ISBN: 3838372654

[SR: 15309627], Paperback, [EAN: 9783838372655], LAP LAMBERT Academic Publishing, LAP LAMBERT Academic Publishing, Book, [PU: LAP LAMBERT Academic Publishing], LAP LAMBERT Academic Publishing, The fundamental idea of chemistry is that the physical and chemical properties of molecules are determined in terms of their topological and electronic structures. It is widely accepted that the structural formula of an organic compound contains all its chemical,biological and physical properties coded in it.The drug- bacteria interaction is nothing but simply a chemical process. Many drug active molecules act by binding specifically and all of the sites of a molecule are not active. Drug- bacteria interaction takes place not globally but locally.The QSAR and QSPR are the attempts to correlate structural or property descriptors of compounds with some of their specific biological activity in terms of some mathematical formulations.In this works, within the paradigm of QSAR/QSPR and using global and local reactivity descriptors of DFT and MO theory we have found a nice correlation between theoretically computed and experimentally determined drug activities., 16052591, Physical Chemistry, 13588, Physical & Theoretical, 13570, Chemistry, 75, Science & Math, 1000, Subjects, 283155, Books

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Quantum Chemical Reactivity Descriptors in Computational Drug Design: On the Applicability of the Quantum Chemical Reactivity Descriptors in Computational Drug Design - Nazmul Islam
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Nazmul Islam:
Quantum Chemical Reactivity Descriptors in Computational Drug Design: On the Applicability of the Quantum Chemical Reactivity Descriptors in Computational Drug Design - Taschenbuch

2010, ISBN: 3838372654

Paperback, [EAN: 9783838372655], LAP LAMBERT Academic Publishing, LAP LAMBERT Academic Publishing, Book, [PU: LAP LAMBERT Academic Publishing], 2010-06-15, LAP LAMBERT Academic Publishing, The fundamental idea of chemistry is that the physical and chemical properties of molecules are dete...., 278020, Physical Chemistry, 278004, Chemistry, 57, Science & Nature, 1025612, Subjects, 266239, Books, 564342, Chemistry, 564334, Scientific, Technical & Medical, 1025612, Subjects, 266239, Books

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Quantum Chemical Reactivity Descriptors in Computational Drug Design: On the Applicability of the Quantum Chemical Reactivity Descriptors in Computational Drug Design - Nazmul Islam
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Nazmul Islam:
Quantum Chemical Reactivity Descriptors in Computational Drug Design: On the Applicability of the Quantum Chemical Reactivity Descriptors in Computational Drug Design - Taschenbuch

ISBN: 3838372654

Taschenbuch, [EAN: 9783838372655], LAP LAMBERT Academic Publishing, LAP LAMBERT Academic Publishing, Book, [PU: LAP LAMBERT Academic Publishing], LAP LAMBERT Academic Publishing, 56062011, Physisch & Theoretisch, 56048011, Chemie, 56047011, Wissenschaft, 54071011, Genres, 52044011, Fremdsprachige Bücher

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Quantum Chemical Reactivity Descriptors in Computational Drug Design - Islam, Nazmul
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Quantum Chemical Reactivity Descriptors in Computational Drug Design - Taschenbuch

2010, ISBN: 3838372654

Gebundene Ausgabe, ID: 8144299

On the Applicability of the Quantum Chemical Reactivity Descriptors in Computational Drug Design - Buch, gebundene Ausgabe, 112 S., Beilagen: Paperback, Erschienen: 2010 LAP Lambert Acad. Publ.

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Quantum Chemical Reactivity Descriptors in Computational Drug Design

The fundamental idea of chemistry is that the physical and chemical properties of molecules are determined in terms of their topological and electronic structures. It is widely accepted that the structural formula of an organic compound contains all its chemical,biological and physical properties coded in it.The drug- bacteria interaction is nothing but simply a chemical process. Many drug active molecules act by binding specifically and all of the sites of a molecule are not active. Drug- bacteria interaction takes place not globally but locally.The QSAR and QSPR are the attempts to correlate structural or property descriptors of compounds with some of their specific biological activity in terms of some mathematical formulations.In this works, within the paradigm of QSAR/QSPR and using global and local reactivity descriptors of DFT and MO theory we have found a nice correlation between theoretically computed and experimentally determined drug activities.

Detailangaben zum Buch - Quantum Chemical Reactivity Descriptors in Computational Drug Design


EAN (ISBN-13): 9783838372655
ISBN (ISBN-10): 3838372654
Gebundene Ausgabe
Taschenbuch
Erscheinungsjahr: 2010
Herausgeber: AV Akademikerverlag GmbH & Co. KG.

Buch in der Datenbank seit 28.03.2008 11:45:54
Buch zuletzt gefunden am 26.02.2017 21:15:12
ISBN/EAN: 9783838372655

ISBN - alternative Schreibweisen:
3-8383-7265-4, 978-3-8383-7265-5


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