Repositioning Cannabinoids and Terpenes as Novel EGFR-TKIs Candidates for Targeted Therapy Against Cancer: A virtual screening model using CADD and biophysical simulations.
Breast & Lung Cancer
CADD
Cannabinoids & Terpenes
Cannabis sativa L.
EGFR-TKIs
MM-GBSA free Binding energy
Molecular Dynamics
Semi-flexible & Flexible Molecular Docking
The inhibition constant (Ki)
Virtual Screening
Journal
Heliyon
ISSN: 2405-8440
Titre abrégé: Heliyon
Pays: England
ID NLM: 101672560
Informations de publication
Date de publication:
Apr 2023
Apr 2023
Historique:
received:
05
12
2022
revised:
07
04
2023
accepted:
13
04
2023
medline:
2
5
2023
pubmed:
2
5
2023
entrez:
2
5
2023
Statut:
epublish
Résumé
This study examines the potential of
Identifiants
pubmed: 37128337
doi: 10.1016/j.heliyon.2023.e15545
pii: S2405-8440(23)02752-4
pmc: PMC10148140
doi:
Types de publication
Journal Article
Langues
eng
Pagination
e15545Informations de copyright
© 2023 The Authors. Published by Elsevier Ltd.
Déclaration de conflit d'intérêts
The authors reported in the manuscript has no any conflict of interest.
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