Simulation Topologies and Structures
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Inclosed in this .zip file are some of the files used to produce the results shown in "Controlling Swelling in Mixed Transport Polymers Through Alkyl Side Chain Physical Cross-linking" published in PNAS. Files include: - topology files - the forcefield used for the simulation - a README file to navigate what is in the different folders - final structures for each of the simulations - checkpoint files so the simulations can be continued by other users. For any more data or for the trajectories of the simulations please contact the authors.
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Zenodo创建时间：
2023-06-20
