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Parameters for the solvated KcsA-K+-LAB-TEA, when both LAB-TEA and K+-ion placed inside the channel cavity

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Zenodo2023-08-07 更新2026-05-26 收录
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Parameters for the solvated KcsA-K<sup>+</sup>-LAB-TEA. These KcsA-K<sup>+</sup>-LAB-TEA systems were solvated by truncated octahedron TIP3PBOX, using the leap program in AMBER20. Both LAB-TEA and K<sup>+</sup>-ion are placed inside the channel cavity.

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Zenodo
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2023-08-07
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