Dataset on insight into inhibition capacity of cyclic tetra-amino acid based compounds as efficient crystal structure of human insulin-degrading enzyme inhibitorsMendeley Data

Dataset on insight into inhibition capacity of cyclic tetra-amino acid based compounds as efficient crystal structure of human insulin-degrading enzyme inhibitorsMendeley Data

The biochemical evaluation of nine cyclopeptide derivatives were investigated using computational approaches. Key software in drug design and discovery (Spartan for optimization; Molecular operating environment (MOE) for induced fit docking; ADMETSar for pharmacokinetics; GROMACS for molecular dynam...

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Main Authors: Cecilia O. Akintayo, Abel Kolawole Oyebamiji, Arogundade Ibukun O, Adeniyi Adebayo, Sunday Adewale Akintelu, Samson Olusegun Afolabi, Oluwakemi Ebenezer
Format: Article
Language:English
Published: Elsevier 2025-10-01
Series:Data in Brief
Subjects:
Crystal, diabetes
Insulin
Peptides
Simulation
Online Access:http://www.sciencedirect.com/science/article/pii/S2352340925006687
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