Parameters for the solvated KcsA-LAB-TEA, when the LAB-TEA is placed inside the channel cavity without K+-ion

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https://zenodo.org/record/8220839

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Parameters for the solvated KcsA-LAB-TEA. These KcsA-LAB-TEA systems were solvated by truncated octahedron TIP3PBOX, using the leap program in AMBER20. The LAB-TEA is placed inside the channel cavity. The simulation is performed without K+-ion.

创建时间：

2023-08-08