Published June 28, 2021
| Version 1
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Polyelectrolyte in a water cavity
Description
The compressed file provide 400 snapshots of a molecular dynamics simulation performed at ambient condition using the POLARIS(MD) code (http://biodev.cea.fr/polaris/) and polarizable force fields of a polyelectrolyte in compact quasi spherical conformation as embedded in a spherical cavity comprising about 7 500 water molecules.
Files
Files
(142.0 MB)
Name | Size | Download all |
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md5:e4f5559c382358fc23141aa055517ddd
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142.0 MB | Download |