dataset · Zenodo (CERN European Organization for Nuclear Research)

Data and code for "Design Principles for Natural SGLT2 Modulators from Multiscale Computation"

Oussama Khibech
Mohamed Bouhrim
Yousra Hammouti
Fahd A. Nasr
Mohammed Al-Zharani
Mohammed Merzouki
Ashraf Ahmed Qurtam
Mohamed Addi
Said Abadi
Allal Challioui

2026Open accessMohamed I University

Abstract

All data, input files, analysis scripts, and materials required to reproduce this study, including the POPC membrane molecular dynamics simulations, are freely available at https://github.com/khibech/POPC.SGLT2 and have been archived in the Zenodo repository at https://doi.org/10.5281/zenodo.22230678.

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DOI: 10.5281/zenodo.22230678

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