tanmoy.7989 bbb0f5740e link to data.peptide was deleted by me by mistake. Now that it's re-added, I revoked (un-necessary) changes I made since to the in.peptide input script

2019-09-06 11:18:33 -07:00

..

data.peptide

re-add link to data.peptide file, which got deleted somehow

2019-09-06 13:25:31 -04:00

in.peptide

link to data.peptide was deleted by me by mistake. Now that it's re-added, I revoked (un-necessary) changes I made since to the in.peptide input script

2019-09-06 11:18:33 -07:00

parse_ene.py

python tool to reorder replica traj

2019-09-04 15:26:10 -07:00

run.sh

(a)fixed bz2 import, (b)linked to data.peptide in examples/peptide, (c)added a runlog

2019-09-05 21:19:57 -07:00

runlog.05Sep19

(a)fixed bz2 import, (b)linked to data.peptide in examples/peptide, (c)added a runlog

2019-09-05 21:19:57 -07:00

temps.txt

python tool to reorder replica traj

2019-09-04 15:26:10 -07:00