Put SIngularity under bump_version.py control

scripts/bump-version.py

@@ -35,3 +35,13 @@ for i, line in enumerate(lines):
   if line.startswith("ARG OPENSTRUCTURE_VERSION"):
     lines[i] = 'ARG OPENSTRUCTURE_VERSION="%s"\n' % version_string
 open("docker/Dockerfile", "w").writelines(lines)
+
+# fix Singularity recipe
+vfile = "singularity/Singularity"
+lines = open(vfile).readlines()
+for i, line in enumerate(lines):
+  if line.startswith("From: registry.scicore.unibas.ch/schwede/openstructure:"):
+    lines[i] = 'From: registry.scicore.unibas.ch/schwede/openstructure:'+\
+      '"%s"' % version_string
+    break
+open(vfile, "w").writelines(lines)

singularity/Singularity

 BootStrap: docker
-From: registry.scicore.unibas.ch/schwede/openstructure:python3_test2
-
+From: registry.scicore.unibas.ch/schwede/openstructure:"2.0.0"
 
 %post
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