chemistry-knowledge / test_release.py
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Release ChemBricks curated knowledge 2026-09-17.1
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"""Regression checks for public-copy curation and provenance."""
import copy
import hashlib
import json
import pytest
from build_dataset import clean_claim_ids, privacy_issues, public_tool_row, schema_for
from verify import pointer, verify_evidence
def canonical(value):
return json.dumps(value, sort_keys=True, separators=(",", ":"), ensure_ascii=False, allow_nan=False).encode()
def example_row():
# Synthetic bookkeeping fixture, not a chemistry observation.
value = {"line": 7, "ts": "2026-09-17T00:00:00Z", "duration_ms": 1,
"tool": "fixture_tool", "args": {"smiles": "C", "properties": ["fixture"]},
"request_id": "fixture-request", "status": "ok",
"request": {"id": 1, "jsonrpc": "2.0", "method": "tools/call",
"params": {"name": "fixture_tool", "arguments": {"smiles": "C", "properties": ["fixture"]},
"_meta": {"workspaces": {"/home/example/private": {"session": "not-public"}}}}},
"response": {"jsonrpc": "2.0", "id": 1, "result": {
"_meta": {"request_id": "fixture-request", "model_version": "fixture-v1"},
"structuredContent": {"number": 1.25, "trust_factor": 75.5}}}}
value["sha256"] = hashlib.sha256(canonical(value)).hexdigest()
return value
def public_projection():
original = example_row()
public, removed = public_tool_row(original)
return original, public, {
"request_id": public["request_id"], "tool": public["tool"], "status": public["status"],
"timestamp": public["ts"], "duration_ms": public["duration_ms"], "source_line": public["line"],
"row_sha256": public["sha256"], "source_row_sha256": original["sha256"],
"omitted_metadata_fields": removed, "args_json": json.dumps(public["args"]),
"response_json": json.dumps(public["response"]), "public_row_json": json.dumps(public),
}
def test_projection_removes_only_client_metadata():
original = example_row()
before = copy.deepcopy(original)
public, removed = public_tool_row(original)
assert original == before
assert public["args"] == original["args"]
assert public["response"] == original["response"]
assert public["response"]["result"]["_meta"]["request_id"] == "fixture-request"
assert removed == ["request.params._meta"]
assert public["sha256"] != original["sha256"]
assert not privacy_issues(public)
assert privacy_issues(original)
def test_public_evidence_hash_checks_the_response():
original, public, exported = public_projection()
verify_evidence(exported)
public["response"]["result"]["structuredContent"]["number"] = 2.5
exported["response_json"] = json.dumps(public["response"])
exported["public_row_json"] = json.dumps(public)
with pytest.raises(AssertionError, match="hash"):
verify_evidence(exported)
def test_flat_argument_column_cannot_disagree_with_public_row():
_, _, exported = public_projection()
exported["args_json"] = json.dumps({"smiles": "CC"})
with pytest.raises(AssertionError, match="Arguments"):
verify_evidence(exported)
def test_passed_arithmetic_does_not_override_ineligible_sources():
record = {"claims": [{"id":"primary", "verdict":"inconclusive"},
{"id":"arithmetic", "verdict":"passed"},
{"id":"independent", "verdict":"passed"}]}
confidence = {"primary":{"context_eligible":False},
"arithmetic":{"context_eligible":False},
"independent":{"context_eligible":True}}
assert clean_claim_ids(record,confidence) == {"independent"}
def test_schema_supports_nullable_scalars_and_rejects_shape_drift():
schema = schema_for([{"value":None,"tags":[]}, {"value":1.0,"tags":["low-trust"]}])
assert schema["properties"]["value"]["type"] == ["null","number"]
with pytest.raises(ValueError, match="columns"):
schema_for([{"value":1}, {"unexpected":1}])
def test_pointer_decodes_nested_response_text_and_escaped_keys():
response = {"result":{"content":[{"text":json.dumps({"a/b":{"~key":1.25}})}]}}
assert pointer(response,"/result/content/0/text/a~1b/~0key") == 1.25
with pytest.raises(KeyError):
pointer(response,"/result/absent")
def test_secret_scan_checks_dictionary_keys_as_well_as_values():
assert privacy_issues({"workspaces":{"/home/example/private":{}}})
assert privacy_issues("gh" + "p_" + "x"*40)
assert not privacy_issues({"request_id":"fixture-request","model":"recorded-model"})