Article

Mapping Structural Drivers of Insulin Analogs Using Molecular Dynamics and Free Energy Calculations at Insulin Receptor

2022-05-28

Abstract excerpt

A century on from the discovery of insulin, a complete understanding of insulin interactions with the insulin receptor (IR) at atomic level remains elusive. In this work, we have leveraged recent advancements in structural biology that have resulted in multiple high-resolution structures of the insulin-IR complex. As a first step, we employed molecular dynamics (MD) simulations to unravel atomic insights into the...

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Literature Corpus work: 7db4e8a4-58cb-5d9f-92ab-3cdeadbe35b9
DOI: 10.1101/2022.05.27.493461

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