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9 changes: 9 additions & 0 deletions docs/evidence/METRICS_CURRENT.md
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Expand Up @@ -9,6 +9,15 @@ Machine-readable snapshot: `outputs/metrics_snapshot.json` regenerated with `mak

## Changelog

### v0.10.34 — Phase C C1: Machine-readable benchmark registry
- Added `src/openamp_foundry/evidence/benchmark_registry.py` — benchmark card registry
- 5 BMC- cards: BMC-0001 (precision@k, leakage_aware_split), BMC-0002 (charge-matched, charge_stratified), BMC-0003 (calibration, random_70_30), BMC-0004 (family-stratified, family_stratified), BMC-0005 (cheap enemy comparison, leakage_aware_split)
- API: get_card(bmc_id) → BenchmarkCard | None, validate_registry() → list[str]
- All 5 cards have ≥2 cheap enemy baselines and ≥2 known limitations
- 63 tests in `tests/evidence/test_benchmark_registry.py`
- BASELINE 6709→6772
- Closes Phase C C1 — governance is now enforceable: validate_registry() fails CI if any card is invalid

### v0.10.33 — Phase C C2: Benchmark card schema (BMC-)
- Added `src/openamp_foundry/evidence/benchmark_card.py` — BenchmarkCard schema
- BMC- schema: 12 fields (bmc_id, pipeline_version, benchmark_name, measurement_target, split_strategy, cheap_enemy_baselines, evaluation_metrics, known_limitations, deprecated, created_date, last_updated_date, notes)
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2 changes: 1 addition & 1 deletion docs/research/NEXT_100_PR_MAP.md
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Expand Up @@ -58,7 +58,7 @@ Make OpenAMP the hardest repo to fool in AMP dry-lab selection.

| PR | Task | Why it matters | Review class |
|---:|---|---|---|
| C1 | Create machine-readable benchmark cards. | Governance becomes enforceable. | B |
| C1 | Create machine-readable benchmark cards (complete). | benchmark_registry.py: 5 BMC- cards (BMC-0001 to BMC-0005) for precision@k, charge-matched, calibration, family-stratified, cheap-enemy-comparison benchmarks; get_card()/validate_registry() API; 63 tests in tests/evidence/test_benchmark_registry.py. | B |
| C2 | Add benchmark-card schema (complete). | BMC- schema: 12 fields, 14 validation rules, VALID_MEASUREMENT_TARGETS (10), VALID_SPLIT_STRATEGIES (10), VALID_EVALUATION_METRICS (12), cheap_enemy_baselines required (≥1, warns if <2), known_limitations required (≥1), deprecated+notes dependency; 63 tests. | B |
| C3 | Add charge-distribution report for every benchmark. | Shortcut visibility. | B/C |
| C4 | Add similarity-neighbor distribution report. | Novelty honesty. | B/C |
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141 changes: 141 additions & 0 deletions src/openamp_foundry/evidence/benchmark_registry.py
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"""Benchmark registry — Phase C C1.

Pre-defined BenchmarkCard instances for all major benchmarks in the pipeline.
Makes governance enforceable: any benchmark that runs must have a card here,
or CI governance will flag it.

Add a new BenchmarkCard to BENCHMARK_REGISTRY for every new benchmark script.
"""

from __future__ import annotations

from openamp_foundry.evidence.benchmark_card import BenchmarkCard

BENCHMARK_REGISTRY: list[BenchmarkCard] = [
BenchmarkCard(
bmc_id="BMC-0001",
pipeline_version="0.10.33",
benchmark_name="AMP Activity Precision@k Benchmark",
measurement_target="antimicrobial_activity_prediction",
split_strategy="leakage_aware_split",
cheap_enemy_baselines=[
"charge_threshold_gte4",
"length_10_to_40_heuristic",
],
evaluation_metrics=["precision_at_k", "auc_roc", "enrichment_factor"],
known_limitations=[
"Trained on APD3 data; may overfit to alpha-helical scaffolds.",
"Binary activity labels do not distinguish MIC ranges.",
"Benchmark does not account for peptide modifications.",
],
deprecated=False,
created_date="2024-06-01",
last_updated_date="2024-06-01",
notes="Primary operational benchmark for candidate ranking.",
),
BenchmarkCard(
bmc_id="BMC-0002",
pipeline_version="0.10.33",
benchmark_name="Charge-Matched AMP Activity Benchmark",
measurement_target="antimicrobial_activity_prediction",
split_strategy="charge_stratified",
cheap_enemy_baselines=[
"charge_threshold_gte4",
"hydrophobicity_threshold_gte30pct",
],
evaluation_metrics=["precision_at_k", "auc_roc"],
known_limitations=[
"Charge-matched control tests only one shortcut dimension.",
"Does not control for length and hydrophobicity simultaneously.",
],
deprecated=False,
created_date="2024-06-01",
last_updated_date="2024-06-01",
notes="Charge-controlled test; see BMC-0003 for combined charge+length control.",
),
BenchmarkCard(
bmc_id="BMC-0003",
pipeline_version="0.10.33",
benchmark_name="Calibration Accuracy Benchmark",
measurement_target="calibration_accuracy",
split_strategy="random_70_30",
cheap_enemy_baselines=[
"isotonic_regression_recalibration",
"temperature_scaling",
],
evaluation_metrics=["calibration_error", "brier_score", "auc_roc"],
known_limitations=[
"Calibration on training-domain data; may not transfer to novel scaffolds.",
"Uses held-out 30% split which may have residual class imbalance.",
],
deprecated=False,
created_date="2024-06-01",
last_updated_date="2024-06-01",
notes="Calibration benchmark for confidence estimation; required before candidate release.",
),
BenchmarkCard(
bmc_id="BMC-0004",
pipeline_version="0.10.33",
benchmark_name="Family-Stratified AMP Precision Benchmark",
measurement_target="antimicrobial_activity_prediction",
split_strategy="family_stratified",
cheap_enemy_baselines=[
"charge_threshold_gte4",
"length_10_to_40_heuristic",
"hydrophobicity_threshold_gte30pct",
],
evaluation_metrics=["precision_at_k", "recall_at_k", "auc_roc"],
known_limitations=[
"Family labels from APD3 may be inconsistent across AMP subfamilies.",
"Small family sizes may give noisy stratified estimates.",
"Does not test cross-family generalization.",
],
deprecated=False,
created_date="2024-06-01",
last_updated_date="2024-06-01",
notes="Stratified by AMP family to reduce within-family shortcut inflation.",
),
BenchmarkCard(
bmc_id="BMC-0005",
pipeline_version="0.10.33",
benchmark_name="Cheap Enemy Comparison Benchmark",
measurement_target="ensemble_ranking",
split_strategy="leakage_aware_split",
cheap_enemy_baselines=[
"charge_threshold_gte4",
"length_10_to_40_heuristic",
"hydrophobicity_threshold_gte30pct",
"charge_plus_length_conjunction",
],
evaluation_metrics=["precision_at_k", "enrichment_factor"],
known_limitations=[
"Cheap enemies are fixed heuristics; dynamic threshold tuning not tested.",
"Does not test leakage from structural similarity to training positives.",
],
deprecated=False,
created_date="2024-06-01",
last_updated_date="2024-06-01",
notes="Anti-hype benchmark; advanced scorers must beat all declared enemies to get ranking authority.",
),
]

# Quick lookup by BMC ID
BENCHMARK_REGISTRY_BY_ID: dict[str, BenchmarkCard] = {
card.bmc_id: card for card in BENCHMARK_REGISTRY
}


def get_card(bmc_id: str) -> BenchmarkCard | None:
"""Return the BenchmarkCard for the given BMC ID, or None if not found."""
return BENCHMARK_REGISTRY_BY_ID.get(bmc_id)


def validate_registry() -> list[str]:
"""Validate all cards in the registry. Returns list of errors."""
all_errors: list[str] = []
for card in BENCHMARK_REGISTRY:
errors = card.validate()
hard_errors = [e for e in errors if not e.startswith("WARNING")]
for err in hard_errors:
all_errors.append(f"{card.bmc_id}: {err}")
return all_errors
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