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98257b746c
MD-Bench
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data
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argon_1000
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Rafael Ravedutti
5341938b60
Increase cutoff for Argon case
...
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2023-04-03 15:06:32 +02:00
..
argon_1ns.gro
Allow parameter reading from files and update data
2022-03-05 03:21:52 +01:00
conf.gro
Allow parameter reading from files and update data
2022-03-05 03:21:52 +01:00
grompp.mdp
Allow parameter reading from files and update data
2022-03-05 03:21:52 +01:00
mdbench_params.conf
Increase cutoff for Argon case
2023-04-03 15:06:32 +02:00
tprout.gro
Allow parameter reading from files and update data
2022-03-05 03:21:52 +01:00