Molecular dynamics trajectories: algal lipids bound to Vibrio cholerae ToxT
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资源简介：
50 ns molecular dynamics trajectories (n=3 replicates per system) of algal lipid–ToxT complexes, docked against PDB 3GBG, simulated with OpenMM. Includes trajectories (traj.dcd), serialized systems (system.xml), topologies (system.pdb / system_pub.pdb), and production logs for 14 systems.
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Zenodo创建时间：
2026-08-03
