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polybinder
Initialization of thermoplastic polymer systems to simulate thermal welding
GNU General Public License v3.0
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update pekk charges using resp calcs on mid monomer of 5mer
#98
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chrisjonesBSU
closed
1 year ago
chrisjonesBSU
commented
1 year ago
This PR updates the charge values in the PEKK JSON file
This PR updates the charge values in the PEKK JSON file