UNRES-Dock example output
[unres.git] / examples / UNRES-Dock / output / cluster.inp
1 clustering
2 ncut=1 temper=300 iopt=1      rescale=2 PRINT_CART PDBOUT=1                    &
3 nclust=10 CONSTR_HOMOL=24 one_letter nres=314
4 WSC=0.82686 WSCP=0.96947 WELEC=0.79373 WBOND=1.00000 WANG=0.46542              &
5 WSCLOC=0.07969 WTOR=0.81684 WTORD=0.67806 WCORRH=0.00000 WCORR5=0.00000        &
6 WCORR6=0.00000 WEL_LOC=0.71100 WTURN3=2.30298 WTURN4=0.86517 WTURN6=0.00000    &
7 WSCCOR=0.14577 WVDWPP=0.17781 WHPB=1.00000 WSCP14=0.00000                      &
8 CUTOFF=7.00000 WCORR4=0.00000
9 XDWTTFRRVFLIDDAWRPLMEPELANPLTAHLLAEYNRRCQTEEVLPPREDVFSWTRYCTPDEVRVVIIGQDPYHHPGQA
10 HGLAFSVRANVPPPPSLRNVLAAVKNCYPEARMSGHGCLEKWARDGVLLLNTTLTVKRGAAASHSRIGWDRFVGGVIRRL
11 AARRPGLVFMLWGTHAQNAIRPDPRVHCVLKFSHPSPLSKVPFGTCQHFLVANRYLETRSISPIDWSVXXTNLSDIIEKE
12 TGKQLVIQESILMLPEEVEEVIGNKPESDILVHTAYDESTDENVMLLTSDAPEYKPWALVIQDSNGENKIKMLX
13 0
14 HOMOL_DIST=0.10 HOMOL_ANGLE=1.0 HOMOL_THETA=1.0 HOMOL_SCD=1.0 DIST_CUT=15.0    &
15 READ2SIGMA
16 ./model01.pdb
17 ./model02.pdb
18 ./model03.pdb
19 ./model04.pdb
20 ./model05.pdb
21 ./model06.pdb
22 ./model07.pdb
23 ./model08.pdb
24 ./model09.pdb
25 ./model10.pdb
26 ./model11.pdb
27 ./model12.pdb
28 ./model13.pdb
29 ./model14.pdb
30 ./model15.pdb
31 ./model16.pdb
32 ./model17.pdb
33 ./model18.pdb
34 ./model19.pdb
35 ./model20.pdb
36 ./model21.pdb
37 ./model22.pdb
38 ./model23.pdb
39 ./model24.pdb