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Simulation files of PhD dissertation 'Molecular Simulation of Deep Eutectic Solvents'

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https://figshare.com/articles/dataset/Simulation_files_of_PhD_dissertation_Molecular_Simulation_of_Deep_Eutectic_Solvents_/18996992
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资源简介:
The files here correspond to simulations performed for the PhD dissertation 'Molecular Simulation of Deep Eutectic Solvents'. For each chapter of the dissertation, the simulation input and output files of a single system are provided. Within each simulation folder, a README.txt file exists, in which the details of the simulation and the files are explained.
创建时间:
2022-01-26
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