Research data supporting On the Accuracy of One and Two Particle Solvation Entropies
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https://www.repository.cam.ac.uk/handle/1810/264356
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资源简介：
This is the data associated with the publication "On the Accuracy of One and Two Particle Solvation Entropies" by B.W.J Irwin and D.J. Huggins. It contains: 1) The input files for the NAMD code used to run the simulations mentioned in the work. 2) The data files used to make plots shown in the paper. 3) A spreadsheet used to keep track of calculations made for the paper. 4) C codes for entropy calculations 5) Perl codes for running MD simulations in NAMD
提供机构：
Apollo - University of Cambridge Repository
创建时间：
2017-05-02
