Synopsis
The purpose of this thesis is to correlate the DFT results with the reported antifungal and or antibiotic activities. The optimized molecular geometry, bond lengths, bond angles and band gap were investigated. In this regard various heterocyclic compounds were used to find out their Quantum chemical parameters of the compounds viz. EA, IP, Electronegativity, hardness and softness showed strong correlation with the reported antifungal activity of studied compounds. Geometrical parameters have been compared with the available experimental results. The structure-activity relationship was also studied. The heterocyclic compounds studied in the era of the current thesis are benzoyl thiourea derivatives Linked with morpholine and piperidine, thiourea derivatives containing a thiazole moiety and allantofuranone and related compounds containing -lactone.
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DFT BASED STUDY OF BIOLOGICALLY ACTIVE HETEROCYCLIC COMPOUNDS
Edité par
LAP LAMBERT Academic Publishing Okt 2022, 2022
ISBN 10 : 6205510308
ISBN 13 : 9786205510308
Neuf
Taschenbuch
Vendeur : BuchWeltWeit Ludwig Meier e.K., Bergisch Gladbach, Allemagne
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Taschenbuch. Etat : Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -The purpose of this thesis is to correlate the DFT results with the reported antifungal and or antibiotic activities. The optimized molecular geometry, bond lengths, bond angles and band gap were investigated. In this regard various heterocyclic compounds were used to find out their Quantum chemical parameters of the compounds viz. EA, IP, Electronegativity, hardness and softness showed strong correlation with the reported antifungal activity of studied compounds. Geometrical parameters have been compared with the available experimental results. The structure-activity relationship was also studied. The heterocyclic compounds studied in the era of the current thesis are benzoyl thiourea derivatives Linked with morpholine and piperidine, thiourea derivatives containing a thiazole moiety and allantofuranone and related compounds containing -lactone. 144 pp. Englisch. N° de réf. du vendeur 9786205510308
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DFT BASED STUDY OF BIOLOGICALLY ACTIVE HETEROCYCLIC COMPOUNDS
Edité par
LAP LAMBERT Academic Publishing, 2022
ISBN 10 : 6205510308
ISBN 13 : 9786205510308
Neuf
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DFT BASED STUDY OF BIOLOGICALLY ACTIVE HETEROCYCLIC COMPOUNDS
Edité par
LAP LAMBERT Academic Publishing, 2022
ISBN 10 : 6205510308
ISBN 13 : 9786205510308
Neuf
Taschenbuch
Vendeur : preigu, Osnabrück, Allemagne
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Taschenbuch. Etat : Neu. DFT BASED STUDY OF BIOLOGICALLY ACTIVE HETEROCYCLIC COMPOUNDS | Rameshwar Dongare (u. a.) | Taschenbuch | Englisch | 2022 | LAP LAMBERT Academic Publishing | EAN 9786205510308 | Verantwortliche Person für die EU: preigu GmbH & Co. KG, Lengericher Landstr. 19, 49078 Osnabrück, mail[at]preigu[dot]de | Anbieter: preigu. N° de réf. du vendeur 125798702
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DFT BASED STUDY OF BIOLOGICALLY ACTIVE HETEROCYCLIC COMPOUNDS
Edité par
LAP LAMBERT Academic Publishing Okt 2022, 2022
ISBN 10 : 6205510308
ISBN 13 : 9786205510308
Neuf
Taschenbuch
Vendeur : buchversandmimpf2000, Emtmannsberg, BAYE, Allemagne
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Taschenbuch. Etat : Neu. This item is printed on demand - Print on Demand Titel. Neuware -The purpose of this thesis is to correlate the DFT results with the reported antifungal and or antibiotic activities. The optimized molecular geometry, bond lengths, bond angles and band gap were investigated. In this regard various heterocyclic compounds were used to find out their Quantum chemical parameters of the compounds viz. EA, IP, Electronegativity, hardness and softness showed strong correlation with the reported antifungal activity of studied compounds. Geometrical parameters have been compared with the available experimental results. The structure-activity relationship was also studied. The heterocyclic compounds studied in the era of the current thesis are benzoyl thiourea derivatives Linked with morpholine and piperidine, thiourea derivatives containing a thiazole moiety and allantofuranone and related compounds containing -lactone.VDM Verlag, Dudweiler Landstraße 99, 66123 Saarbrücken 144 pp. Englisch. N° de réf. du vendeur 9786205510308
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DFT BASED STUDY OF BIOLOGICALLY ACTIVE HETEROCYCLIC COMPOUNDS
Edité par
LAP LAMBERT Academic Publishing, 2022
ISBN 10 : 6205510308
ISBN 13 : 9786205510308
Neuf
Taschenbuch
Vendeur : AHA-BUCH GmbH, Einbeck, Allemagne
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Taschenbuch. Etat : Neu. nach der Bestellung gedruckt Neuware - Printed after ordering - The purpose of this thesis is to correlate the DFT results with the reported antifungal and or antibiotic activities. The optimized molecular geometry, bond lengths, bond angles and band gap were investigated. In this regard various heterocyclic compounds were used to find out their Quantum chemical parameters of the compounds viz. EA, IP, Electronegativity, hardness and softness showed strong correlation with the reported antifungal activity of studied compounds. Geometrical parameters have been compared with the available experimental results. The structure-activity relationship was also studied. The heterocyclic compounds studied in the era of the current thesis are benzoyl thiourea derivatives Linked with morpholine and piperidine, thiourea derivatives containing a thiazole moiety and allantofuranone and related compounds containing -lactone. N° de réf. du vendeur 9786205510308
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DFT BASED STUDY OF BIOLOGICALLY ACTIVE HETEROCYCLIC COMPOUNDS
Edité par
LAP LAMBERT Academic Publishing, 2022
ISBN 10 : 6205510308
ISBN 13 : 9786205510308
Neuf
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paperback. Etat : New. NEW. SHIPS FROM MULTIPLE LOCATIONS. book. N° de réf. du vendeur ERICA80062055103086
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