projects
/
unres.git
/ tree
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
| tree
history
|
HEAD
|
snapshot
Merge branch 'devel' into feature-ga
[unres.git]
/
examples
/
unres
/
MD
/
ff_gab
/
drwxr-xr-x
..
-rw-r--r--
953937
1L2Y.pdb
blob
|
history
|
raw
-rw-r--r--
1304
1L2Y_ene.inp
blob
|
history
|
raw
-rw-r--r--
1385
1L2Y_lang-test.inp
blob
|
history
|
raw
-rw-r--r--
1307
1L2Y_minim.inp
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim.intin
blob
|
history
|
raw
-rw-r--r--
19303
1L2Y_minim.out_GB
blob
|
history
|
raw
-rw-r--r--
20322
1L2Y_minim.out_GB000
blob
|
history
|
raw
-rw-r--r--
20448
1L2Y_minim.out_LJ000
blob
|
history
|
raw
-rw-r--r--
822
1L2Y_minim_GB.int
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_GB.mol2
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_GB.pdb
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_GB.stat
blob
|
history
|
raw
-rw-r--r--
822
1L2Y_minim_GB000.int
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_GB000.mol2
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_GB000.pdb
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_GB000.stat
blob
|
history
|
raw
-rw-r--r--
822
1L2Y_minim_LJ000.int
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_LJ000.mol2
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_LJ000.pdb
blob
|
history
|
raw
-rw-r--r--
0
1L2Y_minim_LJ000.stat
blob
|
history
|
raw
-rw-r--r--
1316
1L2Y_minim_cart.inp
blob
|
history
|
raw
-rw-r--r--
926
ala10-cx.inp
blob
|
history
|
raw
-rw-r--r--
0
ala10-cx.intin
blob
|
history
|
raw
-rw-r--r--
13916
ala10-cx.out_GB
blob
|
history
|
raw
-rw-r--r--
2330
ala10-cx.rst
blob
|
history
|
raw
-rw-r--r--
0
ala10-cx_GB.int
blob
|
history
|
raw
-rw-r--r--
0
ala10-cx_GB.mol2
blob
|
history
|
raw
-rw-r--r--
0
ala10-cx_GB.pdb
blob
|
history
|
raw
-rw-r--r--
11716
ala10-cx_GB.stat
blob
|
history
|
raw
-rw-r--r--
3080
ala10-cx_MD.ang
blob
|
history
|
raw
-rw-r--r--
2168
ala10-cx_MD.cx-safe
blob
|
history
|
raw
-rw-r--r--
939
ala10.inp
blob
|
history
|
raw
-rw-r--r--
0
ala10.intin
blob
|
history
|
raw
-rw-r--r--
64217
ala10.out_GB
blob
|
history
|
raw
-rw-r--r--
2262
ala10.rst
blob
|
history
|
raw
-rw-r--r--
13
ala10.seq
blob
|
history
|
raw
-rw-r--r--
4620
ala10MD.ang
blob
|
history
|
raw
-rw-r--r--
3232
ala10MD.cx
blob
|
history
|
raw
-rw-r--r--
0
ala10_GB.int
blob
|
history
|
raw
-rw-r--r--
0
ala10_GB.mol2
blob
|
history
|
raw
-rw-r--r--
0
ala10_GB.pdb
blob
|
history
|
raw
-rw-r--r--
1160232
ala10_GB.stat
blob
|
history
|
raw
-rw-r--r--
853500
ala10_MD.pdb
blob
|
history
|
raw
-rw-r--r--
939
ala10a.inp
blob
|
history
|
raw
-rw-r--r--
43201
ala10a.out_GB
blob
|
history
|
raw
-rw-r--r--
2341
ala10a.rst
blob
|
history
|
raw
-rw-r--r--
390572
ala10a_GB.stat
blob
|
history
|
raw
-rw-r--r--
573440
ala10a_MD.pdb
blob
|
history
|
raw
-rw-r--r--
248
fort.12
blob
|
history
|
raw
-rwxr-xr-x
290
start.mat
blob
|
history
|
raw
-rw-r--r--
11
test.e54333
blob
|
history
|
raw
-rw-r--r--
11
test.e54334
blob
|
history
|
raw
-rw-r--r--
831
test.o54333
blob
|
history
|
raw
-rw-r--r--
831
test.o54334
blob
|
history
|
raw
-rwxr-xr-x
947
unres.csh
blob
|
history
|
raw
-rwxr-xr-x
1201
unres.pbs
blob
|
history
|
raw
-rwxr-xr-x
803
unres_single.sh
blob
|
history
|
raw