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Calmodulin simulation with DESamber (5 replicas)

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Zenodo2024-08-06 更新2026-04-07 收录
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MD simulations of calmodulin with DESamber force field. Five replicas from different starting structures from taken from RCSB PDB: 1CFC (model 1, 5, 10, 15 and 20). Simulations were run wtih 100 mM KCl at 296 K. The trajectory has a saving frequency of 10 ps.

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2024-08-06
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