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Call for Papers:Vol.11 Issue.3

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Title: :  Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking
PaperId: :  22387
Published in:   International Journal Of Advance Research And Innovative Ideas In Education
Publisher:   IJARIIE
e-ISSN:   2395-4396
Volume/Issue:    Volume 10 Issue 1 2024
DUI:    16.0415/IJARIIE-22387
Licence: :   IJARIIE is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

Author NameAuthor Institute
Napeesha MansooriShri Ram Group of Institutions
Dr. Arun Patel Shri Ram Group of Institutions
Mr. Shailendra PatelShri Ram Group of Institutions
Mr. Vijay Pratap AhirwarShri Ram Group of Institutions

Abstract

Pharmaceutical Chemistry
Metal structures, Ligand, ligand-protein, complementarity, dockable, molecular docking, Geometric matching.
Metal structures play an important role in agriculture, pharmacy and industry. Ligand, a metal surrounded by a set of ions or moleMnles, is used to prepare complex substances called sciff bases, Two approaches are particularly popular within the molecular docking community. One approach uses matching technique that describes the protein and the ligand as complementary surfaces .The second approach simulates the docking process in which the ligand-protein pair wise interaction energies are calculated . Both approaches are outlined below. Shape c/ shape complementarity methods describe the protein and ligand as a set of features that make them dockable Two approaches are particularly popular within the molecular docking community. One approach uses matching technique that describes the protein and the ligand as complementary surfaces .The second approach simulates the docking process in which the ligand-protein pair wise interaction energies are calculated . Both approaches are outlined below. Shape complementarity Geometric matching/ shape complementarity methods describe the protein and ligand as a set of features that make them dockable.

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IJARIIE Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar. "Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking" International Journal Of Advance Research And Innovative Ideas In Education Volume 10 Issue 1 2024 Page 116-122
MLA Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar. "Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking." International Journal Of Advance Research And Innovative Ideas In Education 10.1(2024) : 116-122.
APA Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, & Mr. Vijay Pratap Ahirwar. (2024). Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking. International Journal Of Advance Research And Innovative Ideas In Education, 10(1), 116-122.
Chicago Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar. "Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking." International Journal Of Advance Research And Innovative Ideas In Education 10, no. 1 (2024) : 116-122.
Oxford Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar. 'Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking', International Journal Of Advance Research And Innovative Ideas In Education, vol. 10, no. 1, 2024, p. 116-122. Available from IJARIIE, https://ijariie.com/AdminUploadPdf/Computational_Approach_to_Molecular_Catalysis_by_3d_Transition_Metals__through_DFT_spectroscopic_with_molecular_docking_ijariie22387.pdf (Accessed : ).
Harvard Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar. (2024) 'Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking', International Journal Of Advance Research And Innovative Ideas In Education, 10(1), pp. 116-122IJARIIE [Online]. Available at: https://ijariie.com/AdminUploadPdf/Computational_Approach_to_Molecular_Catalysis_by_3d_Transition_Metals__through_DFT_spectroscopic_with_molecular_docking_ijariie22387.pdf (Accessed : )
IEEE Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar, "Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking," International Journal Of Advance Research And Innovative Ideas In Education, vol. 10, no. 1, pp. 116-122, Jan-Feb 2024. [Online]. Available: https://ijariie.com/AdminUploadPdf/Computational_Approach_to_Molecular_Catalysis_by_3d_Transition_Metals__through_DFT_spectroscopic_with_molecular_docking_ijariie22387.pdf [Accessed : ].
Turabian Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar. "Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking." International Journal Of Advance Research And Innovative Ideas In Education [Online]. volume 10 number 1 ().
Vancouver Napeesha Mansoori, Dr. Arun Patel , Mr. Shailendra Patel, and Mr. Vijay Pratap Ahirwar. Computational Approach to Molecular Catalysis by 3d Transition Metals: through DFT spectroscopic with molecular docking. International Journal Of Advance Research And Innovative Ideas In Education [Internet]. 2024 [Cited : ]; 10(1) : 116-122. Available from: https://ijariie.com/AdminUploadPdf/Computational_Approach_to_Molecular_Catalysis_by_3d_Transition_Metals__through_DFT_spectroscopic_with_molecular_docking_ijariie22387.pdf
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