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Relative binding free energies calculated using thermodynamic integration.

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https://figshare.com/articles/dataset/_Relative_binding_free_energies_calculated_using_thermodynamic_integration_/1249090
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资源简介:
The values are averages over two independent calculations of 5 ns length. For the calculation of the standard deviation, each ns simulation time was analyzed independently. Relative binding free energies calculated using thermodynamic integration.
创建时间:
2014-11-21
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