five

EXO5 common haplotypes MD simulation data

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https://zenodo.org/record/14008333
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资源简介:
Molecular Dynamics simulation data for WT, G172V, L151P and G172V+D115N EXO5, bound to a single-strand DNA, as found in PDB 7LW9. .gro, .pdb, .top and .tpr files are provided for the starting structure, along with compressed .xtc trajectories for all simulation replicas, and an .mdp file with the simulation parameters. The trajectories do not include the first 960 ns of simulation, considered as the equilibration cutoff. The .xtc files contain one frame per 100 ps, with all molecules and atoms except water.
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2025-02-17
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