Molecular dynamics trajectories of FabI, MurA and GyrB systems for a Moringa oleifera leaf antibacterial study
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资源简介：
Molecular dynamics input files and 27 triplicate 200 ns trajectories across nine systems for the bacterial targets FabI, MurA and GyrB, supporting the associated npj Science of Food manuscript on Moringa oleifera leaf extract. The archive includes portable run files, effective parameters, run logs, equilibrated starting coordinates, seed records, analysis outputs, checksums and a README.
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Zenodo创建时间：
2026-09-27
