saxs restraints

[django_unres.git] / files / pbs8_new.csh

diff --git a/files/pbs8_new.csh b/files/pbs8_new.csh
index ca528bb..67dcc8c 100755 (executable)
--- a/files/pbs8_new.csh
+++ b/files/pbs8_new.csh
@@ -89,5 +89,15 @@ rm tmp.pdb
 /users2/local/bin/tmscore MODEL5.pdb plik1.pdb > tmscore5.out
 rm plik1.pdb
 
+if (-e saxs.data) then
+awk -f ../files/saxs_dist.awk MODEL1.pdb > MODEL1_saxs.data
+awk -f ../files/saxs_dist.awk MODEL2.pdb > MODEL2_saxs.data
+awk -f ../files/saxs_dist.awk MODEL3.pdb > MODEL3_saxs.data
+awk -f ../files/saxs_dist.awk MODEL4.pdb > MODEL4_saxs.data
+awk -f ../files/saxs_dist.awk MODEL5.pdb > MODEL5_saxs.data
+../files/plot_saxs.py
+endif
+
+
 #END
 touch finished