Do not test ref_pos which depends on a specific RDKit version

PiperOrigin-RevId: 716300884
google-deepmind · Jan 16, 2025 · 5c0379c · 5c0379c
1 parent 155f844
commit 5c0379c
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diff --git a/src/alphafold3/.github/workflows/ci.yaml → .github/workflows/ci.yaml b/src/alphafold3/.github/workflows/ci.yaml → .github/workflows/ci.yaml
diff --git a/run_alphafold_data_test.py b/run_alphafold_data_test.py
@@ -209,6 +209,7 @@ def test_featurisation(self):
         ccd=chemical_components.cached_ccd(),
         buckets=None,
     )
+    del featurised_example[0]['ref_pos']  # Depends on specific RDKit version.
 
     with _output('featurised_example.pkl') as (_, output):
       output.write(pickle.dumps(featurised_example))

diff --git a/src/alphafold3/test_data/featurised_example.json b/src/alphafold3/test_data/featurised_example.json
@@ -32,7 +32,6 @@
     "ref_charge": "27898ee238963105942db19f27a980c1fe4f7aeb396c1e5ea4e82da3876deef4",
     "ref_element": "cc437747adeea094daf8a0e551be02f406c7e7d9b0a9328a84a59d907c5492b5",
     "ref_mask": "1e388e40167a4d31291903d74c98544868d0dc574706cdfd259ddd65f56d2993",
-    "ref_pos": "434668a12a296ae06f903e4df3537ea65cb4d942c3ba8c92b30d13d4c192a291",
     "ref_space_uid": "97afd7d9d3ba835731457ef090ba4939d707bb2a270d48fde56369bde8e58e9f",
     "residue_center_index": "dfef3704f73a7ee9a3be86b74e25ecd43e056c76574bc9bb65b6b446eeed87a7",
     "residue_index": "6bf4ea803d0fcd31446e07f6ba9e012f794ced1fe5ad60b7181f66bb92601638",