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Title: :  In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity
PaperId: :  20172
Published in:   International Journal Of Advance Research And Innovative Ideas In Education
Publisher:   IJARIIE
e-ISSN:   2395-4396
Volume/Issue:    Volume 9 Issue 3 2023
DUI:    16.0415/IJARIIE-20172
Licence: :   IJARIIE is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

Author NameAuthor Institute
Vaibhav N. MoharePriyadarshini J. L. College of Pharmacy, Nagpur, Maharashtra, India – 440016
Alpana J. AsnaniPriyadarshini J. L. College of Pharmacy, Nagpur, Maharashtra, India – 440016
Samiksha R. MeharePriyadarshini J. L. College of Pharmacy, Nagpur, Maharashtra, India – 440016
Swapnja B. GunjarkarPriyadarshini J. L. College of Pharmacy, Nagpur, Maharashtra, India – 440016
Monika W. ParatePriyadarshini J. L. College of Pharmacy, Nagpur, Maharashtra, India – 440016
Aditya R. KaikadePriyadarshini J. L. College of Pharmacy, Nagpur, Maharashtra, India – 440016
Tina W. Pandel Priyadarshini J. L. College of Pharmacy, Nagpur, Maharashtra, India – 440016

Abstract

Pharmaceutical Chemistry
Plumeria rubra; Lepeol, Molecular Docking, PyRx Vina auto dock, Chemsketch, ADMET Prediction.
The Apocynaceae family includes the laticiferous trees and bushes known as Plumeria rubra L (also known as Lal champa in Hindi and True Frangipani in English). In the tropical and subtropical parts of the world, these species' plants are widely farmed. The usage of leaves includes stimulant, antipyretic, antifungal, antibacterial, bronchitis, cholera, colds, and coughs.The binding affinity and interactions with amino acids of phytochemicals were evaluated. Target protein protein homology modeling, protein structure validation, and energy minimization were all completed. A comparative in-silico docking analysis with the standard drug was conducted using phytochemicals that had been mentioned in the literature as having properties related to Alzheimer’s activities. These phytochemicals were studied for their absorption, distribution, metabolism, excretion, and toxicity (ADMET) properties and those that passed ADMET filters. Using AutoDock Vina, a preliminary docking study was performed, then AutoDock 4.2.6 and SwissDock were used to validate the results.

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IJARIIE Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel . "In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity" International Journal Of Advance Research And Innovative Ideas In Education Volume 9 Issue 3 2023 Page 879-885
MLA Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel . "In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity." International Journal Of Advance Research And Innovative Ideas In Education 9.3(2023) : 879-885.
APA Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, & Tina W. Pandel . (2023). In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity. International Journal Of Advance Research And Innovative Ideas In Education, 9(3), 879-885.
Chicago Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel . "In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity." International Journal Of Advance Research And Innovative Ideas In Education 9, no. 3 (2023) : 879-885.
Oxford Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel . 'In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity', International Journal Of Advance Research And Innovative Ideas In Education, vol. 9, no. 3, 2023, p. 879-885. Available from IJARIIE, https://ijariie.com/AdminUploadPdf/In_Silico_Studies__Characterization__ADMET_Prediction__and_Molecular_Docking_of_Plumeria_Rubra_Linn_Constituents_and_Their_Alzheimer’s_Activity_ijariie20172.pdf (Accessed : 16 July 2024).
Harvard Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel . (2023) 'In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity', International Journal Of Advance Research And Innovative Ideas In Education, 9(3), pp. 879-885IJARIIE [Online]. Available at: https://ijariie.com/AdminUploadPdf/In_Silico_Studies__Characterization__ADMET_Prediction__and_Molecular_Docking_of_Plumeria_Rubra_Linn_Constituents_and_Their_Alzheimer’s_Activity_ijariie20172.pdf (Accessed : 16 July 2024)
IEEE Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel , "In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity," International Journal Of Advance Research And Innovative Ideas In Education, vol. 9, no. 3, pp. 879-885, May-Jun 2023. [Online]. Available: https://ijariie.com/AdminUploadPdf/In_Silico_Studies__Characterization__ADMET_Prediction__and_Molecular_Docking_of_Plumeria_Rubra_Linn_Constituents_and_Their_Alzheimer’s_Activity_ijariie20172.pdf [Accessed : 16 July 2024].
Turabian Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel . "In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity." International Journal Of Advance Research And Innovative Ideas In Education [Online]. volume 9 number 3 (16 July 2024).
Vancouver Vaibhav N. Mohare, Alpana J. Asnani, Samiksha R. Mehare, Swapnja B. Gunjarkar, Monika W. Parate, Aditya R. Kaikade, and Tina W. Pandel . In-Silico Studies, Characterization, ADMET Prediction, and Molecular Docking of Plumeria Rubra Linn Constituents and Their Alzheimer’s Activity. International Journal Of Advance Research And Innovative Ideas In Education [Internet]. 2023 [Cited : 16 July 2024]; 9(3) : 879-885. Available from: https://ijariie.com/AdminUploadPdf/In_Silico_Studies__Characterization__ADMET_Prediction__and_Molecular_Docking_of_Plumeria_Rubra_Linn_Constituents_and_Their_Alzheimer’s_Activity_ijariie20172.pdf
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