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Parent Directory | - | |||
groel_rhodanense_docking/ | 2022-02-15 20:54 | - | ||
kari/ | 2022-02-15 20:54 | - | ||
translate.ptraj | 2009-04-22 11:24 | 0 | ||
1.png.md5 | 2022-02-15 20:54 | 32 | ||
1rhs.inpcrd.md5 | 2022-02-15 20:54 | 32 | ||
1rhs.prmtop.md5 | 2022-02-15 20:54 | 32 | ||
2.png.md5 | 2022-02-15 20:54 | 32 | ||
3.png.md5 | 2022-02-15 20:54 | 32 | ||
4.png.md5 | 2022-02-15 20:54 | 32 | ||
5.png.md5 | 2022-02-15 20:54 | 32 | ||
6.png.md5 | 2022-02-15 20:54 | 32 | ||
all_1.png.md5 | 2022-02-15 20:54 | 32 | ||
all_2.png.md5 | 2022-02-15 20:54 | 32 | ||
all_3.png.md5 | 2022-02-15 20:54 | 32 | ||
all_4.png.md5 | 2022-02-15 20:54 | 32 | ||
all_5.png.md5 | 2022-02-15 20:54 | 32 | ||
equil1.in.md5 | 2022-02-15 20:54 | 32 | ||
equil2.in.md5 | 2022-02-15 20:54 | 32 | ||
frame50.pdb.50.md5 | 2022-02-15 20:54 | 32 | ||
frame200.pdb.md5 | 2022-02-15 20:54 | 32 | ||
get_frames.ptraj.md5 | 2022-02-15 20:54 | 32 | ||
heat1.in.md5 | 2022-02-15 20:54 | 32 | ||
heat2.in.md5 | 2022-02-15 20:54 | 32 | ||
heat3.in.md5 | 2022-02-15 20:54 | 32 | ||
heat4.in.md5 | 2022-02-15 20:54 | 32 | ||
heat5.in.md5 | 2022-02-15 20:54 | 32 | ||
logfile.md5 | 2022-02-15 20:54 | 32 | ||
mdinfo.md5 | 2022-02-15 20:54 | 32 | ||
min.in.md5 | 2022-02-15 20:54 | 32 | ||
prod.in.md5 | 2022-02-15 20:54 | 32 | ||
prod_300.in.md5 | 2022-02-15 20:54 | 32 | ||
rhod_denatured.pdb.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_equil1.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_equil1.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_equil1.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_equil2.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_equil2.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_equil2.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat1.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat1.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat1.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat2.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat2.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat2.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat3.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat3.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat3.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat4.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat4.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat4.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat5.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat5.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_heat5.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_min.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_min.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_prod.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_prod.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_prod.rst.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_prod_300.mdcrd.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_prod_300.out.md5 | 2022-02-15 20:54 | 32 | ||
rhodanese_prod_300.rst.md5 | 2022-02-15 20:54 | 32 | ||
rmsd.out.md5 | 2022-02-15 20:54 | 32 | ||
rmsd.pdf.md5 | 2022-02-15 20:54 | 32 | ||
rmsd.ps.md5 | 2022-02-15 20:54 | 32 | ||
rmsd.ptraj.md5 | 2022-02-15 20:54 | 32 | ||
snapshots.1.md5 | 2022-02-15 20:54 | 32 | ||
snapshots.2.md5 | 2022-02-15 20:54 | 32 | ||
snapshots.52.md5 | 2022-02-15 20:54 | 32 | ||
snapshots.102.md5 | 2022-02-15 20:54 | 32 | ||
snapshots.152.md5 | 2022-02-15 20:54 | 32 | ||
snapshots.202.md5 | 2022-02-15 20:54 | 32 | ||
start.1.md5 | 2022-02-15 20:54 | 32 | ||
translate.ptraj.md5 | 2022-02-15 20:54 | 32 | ||
get_frames.ptraj | 2009-04-29 13:06 | 96 | ||
min.in | 2009-03-25 11:52 | 113 | ||
prod.in | 2009-03-25 11:52 | 230 | ||
prod_300.in | 2009-03-25 11:52 | 230 | ||
equil1.in | 2009-03-25 11:52 | 294 | ||
equil2.in | 2009-03-25 11:52 | 294 | ||
heat1.in | 2009-03-25 11:52 | 295 | ||
heat2.in | 2009-03-25 11:52 | 297 | ||
heat3.in | 2009-03-25 11:52 | 297 | ||
heat4.in | 2009-03-25 11:52 | 297 | ||
heat5.in | 2009-03-25 11:52 | 297 | ||
rmsd.ptraj | 2009-04-29 13:37 | 312 | ||
mdinfo | 2009-03-25 11:52 | 401 | ||
logfile | 2009-03-25 11:52 | 6.1K | ||
rhodanese_min.out | 2009-03-25 11:52 | 14K | ||
rmsd.ps | 2009-04-29 13:38 | 29K | ||
rmsd.pdf | 2009-04-29 14:00 | 34K | ||
rmsd.out | 2009-04-29 13:37 | 40K | ||
rhodanese_heat2.out | 2009-03-25 11:52 | 61K | ||
rhodanese_heat3.out | 2009-03-25 11:52 | 61K | ||
rhodanese_heat4.out | 2009-03-25 11:52 | 61K | ||
rhodanese_heat5.out | 2009-03-25 11:52 | 61K | ||
rhodanese_equil1.out | 2009-03-25 11:52 | 61K | ||
rhodanese_heat1.out | 2009-03-25 11:52 | 61K | ||
rhodanese_equil2.out | 2009-03-25 11:52 | 61K | ||
6.png | 2009-04-29 13:10 | 141K | ||
4.png | 2009-04-29 13:10 | 143K | ||
5.png | 2009-04-29 13:10 | 147K | ||
3.png | 2009-04-29 13:10 | 149K | ||
1.png | 2009-04-29 13:10 | 153K | ||
2.png | 2009-04-29 13:10 | 159K | ||
1rhs.inpcrd | 2009-03-25 11:52 | 164K | ||
rhodanese_min.rst | 2009-03-25 11:52 | 164K | ||
all_1.png | 2009-04-29 13:12 | 295K | ||
frame50.pdb.50 | 2009-04-01 10:56 | 300K | ||
frame200.pdb | 2009-04-01 10:57 | 300K | ||
snapshots.1 | 2009-04-29 13:06 | 300K | ||
snapshots.2 | 2009-04-29 13:06 | 300K | ||
snapshots.52 | 2009-04-29 13:06 | 300K | ||
snapshots.102 | 2009-04-29 13:06 | 300K | ||
snapshots.152 | 2009-04-29 13:06 | 300K | ||
snapshots.202 | 2009-04-29 13:06 | 300K | ||
start.1 | 2009-04-29 12:51 | 300K | ||
rhodanese_equil1.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_equil2.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_heat1.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_heat2.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_heat3.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_heat4.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_heat5.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_prod.rst | 2009-03-25 11:52 | 327K | ||
rhodanese_prod_300.rst | 2009-03-25 11:52 | 327K | ||
all_2.png | 2009-04-29 13:12 | 418K | ||
all_3.png | 2009-04-29 13:13 | 533K | ||
rhodanese_equil1.mdcrd | 2009-03-25 11:52 | 538K | ||
rhodanese_equil2.mdcrd | 2009-03-25 11:52 | 538K | ||
rhodanese_heat1.mdcrd | 2009-03-25 11:52 | 538K | ||
rhodanese_heat2.mdcrd | 2009-03-25 11:52 | 538K | ||
rhodanese_heat3.mdcrd | 2009-03-25 11:52 | 538K | ||
rhodanese_heat4.mdcrd | 2009-03-25 11:52 | 538K | ||
rhodanese_heat5.mdcrd | 2009-03-25 11:52 | 538K | ||
all_4.png | 2009-04-29 13:13 | 641K | ||
all_5.png | 2009-04-29 13:14 | 743K | ||
1rhs.prmtop | 2009-03-25 11:52 | 1.7M | ||
rhodanese_prod.out | 2009-03-25 11:52 | 4.7M | ||
rhodanese_prod_300.out | 2009-03-25 11:52 | 4.7M | ||
rhodanese_prod.mdcrd | 2009-03-25 11:52 | 53M | ||
rhodanese_prod_300.mdcrd | 2009-03-25 11:52 | 53M | ||
rhod_denatured.pdb | 2009-03-25 12:08 | 91M | ||