"""Architecture validation before any real training. Checks: 1. Dataset integrity: answer marginals ~uniform per k (no majority-class shortcut); LookupSolver scores 100% (pipeline exactness). 2. Gradient flow through recurrence: a 1-block model unrolled R=8 gets non-zero gradients on every block parameter; loss at init is finite. 3. Overfitting a tiny fixed training set: both architectures reach ~100% train accuracy on 256 fixed examples (gradients + capacity are real). 4. Interface checks: n_iters variation works, smaller state spaces evaluate with the same weights (subset of vocab/positions), shapes correct. Exit code 0 iff all checks pass. Run: python validate.py """ import sys import time import numpy as np import torch torch.set_num_threads(8) import torch.nn.functional as F from ptr.common import (LookupSolver, check_answer_marginals, sample_eval_batch, sample_train_batch) from ptr.models import PtrTransformer DEV = "cpu" S, D = 64, 128 def check_marginals_and_lookup(): rng = np.random.default_rng(0) m = check_answer_marginals(rng, S=S, k_max=8, n=100_000) print(f"[1a] answer-marginal TV per k: " f"{ {k: round(v, 4) for k, v in m['tv_per_k'].items()} } -> " f"{'PASS' if m['pass'] else 'FAIL'}") assert m["pass"] solver = LookupSolver() b = sample_eval_batch(rng, 1000, S, k=8) pred = solver.solve(b["f"], b["x"], 8) acc = float((pred == b["answer"]).mean()) print(f"[1b] LookupSolver exact-match on random data: {acc:.4f} -> " f"{'PASS' if acc == 1.0 else 'FAIL'}") assert acc == 1.0 def check_gradients(): torch.manual_seed(0) model = PtrTransformer(S, D, 4, 512, depth=1, zero_init=True).to(DEV) rng = np.random.default_rng(1) b = sample_train_batch(rng, 64, S) f = torch.as_tensor(b["f"], device=DEV) x = torch.as_tensor(b["x"], device=DEV) k = torch.as_tensor(b["k"], device=DEV) y = torch.as_tensor(b["answer"], device=DEV) R = 8 # Zero-initialised output projections make every block the identity at # step 0, so upstream parameters receive no gradient on the very first # backward. Warm up a few AdamW steps first, then check that the full # R=8 unroll propagates gradients to every block parameter. opt = torch.optim.AdamW(model.parameters(), lr=1e-3) for _ in range(3): opt.zero_grad(set_to_none=True) F.cross_entropy(model(f, x, k, n_iters=R), y).backward() opt.step() opt.zero_grad(set_to_none=True) logits = model(f, x, k, n_iters=R) loss = F.cross_entropy(logits, y) loss.backward() bad = [n for n, p in model.named_parameters() if p.requires_grad and (p.grad is None or p.grad.abs().sum() == 0)] print(f"[2] recurrent unroll R={R}: init loss {loss.item():.4f} " f"(uniform would be {np.log(S):.4f}); " f"params with zero/missing grad: {bad or 'none'} -> " f"{'PASS' if not bad and torch.isfinite(loss) else 'FAIL'}") assert not bad and torch.isfinite(loss) def overfit_tiny(depth, n_iters, steps=2500, lr=1e-3, target=0.99): torch.manual_seed(depth * 10 + n_iters) model = PtrTransformer(S, D, 4, 512, depth=depth, zero_init=True).to(DEV) rng = np.random.default_rng(7) fixed = sample_train_batch(rng, 256, S, k_max=8) f = torch.as_tensor(fixed["f"], device=DEV) x = torch.as_tensor(fixed["x"], device=DEV) k = torch.as_tensor(fixed["k"], device=DEV) y = torch.as_tensor(fixed["answer"], device=DEV) opt = torch.optim.AdamW(model.parameters(), lr=lr, weight_decay=0.01) t0 = time.time() acc = 0.0 for i in range(steps): opt.zero_grad(set_to_none=True) logits = model(f, x, k, n_iters=n_iters) loss = F.cross_entropy(logits, y) loss.backward() opt.step() if i % 100 == 0 or i == steps - 1: acc = (logits.argmax(-1) == y).float().mean().item() print(f" depth={depth} R={n_iters} step {i}: " f"loss {loss.item():.4f} acc {acc:.3f} " f"({time.time()-t0:.0f}s)", flush=True) if acc >= target: break acc = (logits.argmax(-1) == y).float().mean().item() ok = acc >= target print(f"[3] overfit tiny set (depth={depth}, R={n_iters}): " f"final acc {acc:.3f} -> {'PASS' if ok else 'FAIL'}") assert ok def check_interface(): torch.manual_seed(3) model = PtrTransformer(S, D, 4, 512, depth=4, zero_init=True).to(DEV) rng = np.random.default_rng(11) for n_iters in (1, 4, 12): b = sample_eval_batch(rng, 8, S, k=16) f = torch.as_tensor(b["f"], device=DEV) x = torch.as_tensor(b["x"], device=DEV) k = torch.as_tensor(b["k"], device=DEV) logits = model(f, x, k, n_iters=n_iters) assert logits.shape == (8, S) # smaller state space with the same weights (subset of vocab + positions) b = sample_eval_batch(rng, 8, 16, k=64) logits = model(torch.as_tensor(b["f"], device=DEV), torch.as_tensor(b["x"], device=DEV), torch.as_tensor(b["k"], device=DEV), n_iters=4) # head is sized to the trained S=64; a smaller eval state space S'=16 # yields 64 logits and must be MASKED to the first S' classes assert logits.shape == (8, 64) assert logits[:, :16].argmax(-1).shape == (8,) print("[4] interface: n_iters 1/4/12 and S=16-subset eval (with head " f"masking) all OK (logits {tuple(logits.shape)}) -> PASS") if __name__ == "__main__": check_marginals_and_lookup() check_gradients() overfit_tiny(depth=4, n_iters=1) overfit_tiny(depth=1, n_iters=4) overfit_tiny(depth=1, n_iters=8) check_interface() print("ALL VALIDATION CHECKS PASSED") sys.exit(0)