From ee7f24e8e2594b7df7b3b9376ceb0a6df2a2940c Mon Sep 17 00:00:00 2001
From: Xavier Robin <xavalias-github@xavier.robin.name>
Date: Tue, 25 Jul 2023 10:37:43 +0200
Subject: [PATCH] test: warn about outdated or missing libs
---
modules/conop/tests/test_complib.py | 10 ++++++++++
1 file changed, 10 insertions(+)
diff --git a/modules/conop/tests/test_complib.py b/modules/conop/tests/test_complib.py
index 99ef78d5a..960d65e0a 100644
--- a/modules/conop/tests/test_complib.py
+++ b/modules/conop/tests/test_complib.py
@@ -3,6 +3,7 @@ import ost
from ost import conop
import subprocess
import tempfile
+import warnings
class TestCompLib(unittest.TestCase):
@@ -43,6 +44,15 @@ class TestCompLib(unittest.TestCase):
self.assertTrue(comp_nh4.atom_specs[0].charge == 1)
self.assertTrue(comp_nh4.atom_specs[1].charge == 0)
+ def test_default_lib_version(self):
+ compound_lib = conop.GetDefaultLib()
+ if compound_lib is None:
+ warnings.warn("Compound library not available. Some functionality may not work as expected.")
+ else:
+ lib_version = compound_lib.GetOSTVersionUsed()
+ if lib_version < ost.__version__:
+ warnings.warn("Using old version of the compound library: %s" % lib_version)
+
if __name__ == "__main__":
from ost import testutils
--
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