Merge branch 'prerelease-3.2.1'

[unres.git] / ctest / 1l2y_csa_local_4P.inp

diff --git a/ctest/1l2y_csa_local_4P.inp b/ctest/1l2y_csa_local_4P.inp
new file mode 100644 (file)
index 0000000..1518f8a
--- /dev/null
+++ b/ctest/1l2y_csa_local_4P.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=1 RMSCUT=3.5 IZ_SC=1 PNCCUT=0.45                   &
+ICMAX=1 IUCUT=2 NBANKM=200
+WLONG=1.00000 WSCP=2.73684 WELEC=0.06833 WANG=4.15526 WSCLOC=0.16761           &
+WTOR=2.99546 WTORD=2.89720 WCORRH=1.98989 WCORR5=0.00000 WCORR6=0.00000        &
+WEL_LOC=1.60072 WTURN3=2.36351 WTURN4=1.34051 WTURN6=0.00000                   &
+WSCCOR=0.1                                                                     &
+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