dfa IDFAMAX=25000
[unres.git] / ctest / dock / cluster.inp
1 2wfu UNRES-Dock 
2 nres=49 one_letter rescale=2 PRINT_CART PDBOUT=1 iopt=1 temper=280.0  ncut=0   &
3  CONSTR_HOMOL=8 pdbref                                                         &
4 BOXX=78.90 BOXY=78.90 BOXZ=78.90
5 WSC=1.00000 WSCP=1.23315 WELEC=0.84476 WBOND=1.00000 WANG=0.62954              &
6 WSCLOC=0.10554 WTOR=1.34316 WTORD=1.26571 WCORRH=0.19212 WCORR5=0.00000        &
7 WCORR6=0.00000 WEL_LOC=0.37357 WTURN3=1.40323 WTURN4=0.64673 WTURN6=0.00000    &
8 WVDWPP=0.23173 WHPB=1.00000 WSCCOR=0.25                                        &
9 CUTOFF=7.00000 WCORR4=0.00000
10 GVVDSCCRNSCSFSTLRAYCDSXXNSLRACGPALMDMLRVACPNGFNSX
11 0
12 HOMOL_DIST=0.1    HOMOL_ANGLE=1.0 HOMOL_THETA=1.0 HOMOL_SCD=1.0 DIST_CUT=15.0  &
13 READ2SIGMA 
14 model01.pdb
15 model02.pdb
16 model03.pdb
17 model04.pdb
18 model05.pdb
19 model06.pdb
20 model07.pdb
21 model08.pdb
22 plik1ter.pdb