How to calculate Life-Time H-Bond with gromacs?

14 August 2023 1 8K Report

I wanted to calculate Life-Time H-Bond I wanted to calculate the H-Bond Life-Time like this table in this article

I kindly beseech your counsel and guidance in navigating this endeavor.

You can get that information by running gmx hbond. For lifetime usually you use the Forward rate (just check the original publications on the tool).

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