Merge branch 'prerelease-3.2.1'

[unres.git] / ctest / 1l2y_csa.inp

diff --git a/ctest/1l2y_csa.inp b/ctest/1l2y_csa.inp
new file mode 100644 (file)
index 0000000..71e9a5a
--- /dev/null
+++ b/ctest/1l2y_csa.inp
@@ -0,0 +1,17 @@
+1l2y
+SEED=-3059743  CSA   MINIMIZE      RESCALE_MODE=0          OVERLAP NOSEARCHSC
+MAXMIN=3000 MAXFUN=1000
+NCONF=50  NSTMAX=10000  N1=2 N2=2 N6=5   N3=0 N4=0 N8=0 IS1=1 IS2=25 NSEED=10  &
+NTOTAL=10000  CUT1=2.0 CUT2=5.0 ESTOP=-900000.0 IRESTART=0 NCONF_IN=0          &
+DELE=30.0 DIFCUT=720.0 IREF=0 RMSCUT=4.0 IZ_SC=1 PNCCUT=0.6                    &
+IMAX=1 IUCUT=2 NBANKM=200
+WSC=1.00000 WSCP=1.23315 WELEC=0.84476 WBOND=1.00000 WANG=0.62954              &
+WSCLOC=0.10554 WTOR=1.34316 WTORD=1.26571 WCORRH=0.19212 WCORR5=0.00000        &
+WCORR6=0.00000 WEL_LOC=0.37357 WTURN3=1.40323 WTURN4=0.64673 WTURN6=0.00000    &
+WVDWPP=0.23173 WHPB=1.00000 WSCCOR=0.25                                        &
+CUTOFF=7.00000 WCORR4=0.00000
+22
+ D   ASN LEU TYR ILE GLN TRP LEU LYS ASP GLY GLY PRO SER SER GLY ARG PRO PRO PRO 
+ SER D 
+0
+0