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UNRES-Dock example output
[unres.git]
/
examples
/
UNRES-Dock
/
cluster2allatom.csh
diff --git
a/examples/UNRES-Dock/cluster2allatom.csh
b/examples/UNRES-Dock/cluster2allatom.csh
index
df01c52
..
683ec64
100755
(executable)
--- a/
examples/UNRES-Dock/cluster2allatom.csh
+++ b/
examples/UNRES-Dock/cluster2allatom.csh
@@
-33,7
+33,7
@@
set j = 2
while ($j <= $numstruc)
grep -v TER structur$j.pdb > structure$i.pdb
grep " A " structure$i.pdb > structure${i}a.pdb
while ($j <= $numstruc)
grep -v TER structur$j.pdb > structure$i.pdb
grep " A " structure$i.pdb > structure${i}a.pdb
-grep " B " structure$i.pdb > structure${i}b.pdb
+egrep " B | C " structure$i.pdb > structure${i}b.pdb
pulchra306/pulchra -q -f -g structure${i}a.pdb
pulchra306/pulchra -q -f -g structure${i}b.pdb
pulchra306/pulchra -q -f -g structure${i}a.pdb
pulchra306/pulchra -q -f -g structure${i}b.pdb