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Commit 8b7007cf authored by Giovanni Bussi's avatar Giovanni Bussi
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regtests

parent bda7c63a
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......@@ -90,6 +90,8 @@ int main(){
test_line(ofs,plumed,"d: RMSD REFERENCE=test-too-many-atoms.pdb");
test_line(ofs,plumed,"d: RMSD TYPE=OPTIMAL REFERENCE=test_zero_displace_weight.pdb");
test_line(ofs,plumed,"d: RMSD TYPE=OPTIMAL REFERENCE=test_zero_align_weight.pdb");
test_line(ofs,plumed,"d: RMSD TYPE=SIMPLE REFERENCE=test_zero_displace_weight.pdb");
test_line(ofs,plumed,"d: RMSD TYPE=SIMPLE REFERENCE=test_zero_align_weight.pdb");
test_line(ofs,plumed,"d: DRMSD REFERENCE=missing.pdb LOWER_CUTOFF=0.0 UPPER_CUTOFF=15.0");
// these should not fail
......
......@@ -44,6 +44,10 @@ readInputLine d: RMSD TYPE=OPTIMAL REFERENCE=test_zero_displace_weight.pdb
+++ catched
readInputLine d: RMSD TYPE=OPTIMAL REFERENCE=test_zero_align_weight.pdb
+++ catched
readInputLine d: RMSD TYPE=SIMPLE REFERENCE=test_zero_displace_weight.pdb
+++ catched
readInputLine d: RMSD TYPE=SIMPLE REFERENCE=test_zero_align_weight.pdb
+++ catched
readInputLine d: DRMSD REFERENCE=missing.pdb LOWER_CUTOFF=0.0 UPPER_CUTOFF=15.0
+++ catched
readInputLine RESTRAINT ARG=x(d) KAPPA=5 AT=0
......
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