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NEO/OTIB reproduction bundle (wsA8LgHU5U)
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"""NEO (Neural Theorizer) and the three monolithic baselines.
Architecture follows Table 19/22 of arXiv:2605.03413v2: shared pretrained
CNN VAE encoder/decoder, FiLM-MLP policy and transition networks, VQ codebook
for the discrete "language of thought", MDL length selection (Eq. 4).
"""
from __future__ import annotations
import torch
import torch.nn as nn
import torch.nn.functional as F
# Scale of the state-grounding term relative to the categorical reconstruction
# loss; see src/_abcheck.py. True = mean over state dims, False = sum (paper's
# literal Eq. 5).
GROUNDING_MEAN = True
# --------------------------------------------------------------------------
# Shared observation autoencoder (pretrained once, reused by every method)
# --------------------------------------------------------------------------
class ConvVAE(nn.Module):
"""Small CNN VAE over (1, H, W) one-hot grids.
The observation always has exactly one active cell per row-group, so the
decoder emits per-cell logits and exact-match decoding is an argmax.
"""
def __init__(self, h, w, state_dim=32, d_model=32, mode="flat"):
super().__init__()
self.h, self.w, self.state_dim = h, w, state_dim
self.mode = mode # "flat" (grid) or "row" (digits)
self.enc = nn.Sequential(
nn.Conv2d(1, d_model, 3, 1, 1), nn.ReLU(),
nn.Conv2d(d_model, d_model, 3, 2, 1), nn.ReLU(),
nn.Conv2d(d_model, d_model, 3, 2, 1), nn.ReLU(),
)
self.eh, self.ew = (h + 3) // 4, (w + 3) // 4
feat = d_model * self.eh * self.ew
self.to_mu = nn.Linear(feat, state_dim)
self.to_lv = nn.Linear(feat, state_dim)
self.from_z = nn.Linear(state_dim, feat)
self.dec = nn.Sequential(
nn.ConvTranspose2d(d_model, d_model, 3, 2, 1), nn.ReLU(),
nn.ConvTranspose2d(d_model, d_model, 4, 2, 1), nn.ReLU(),
)
self.head = nn.Conv2d(d_model, 1, 3, 1, 1)
self.d_model = d_model
def encode(self, x):
f = self.enc(x).flatten(1)
return self.to_mu(f), self.to_lv(f)
def decode(self, s):
f = self.from_z(s).view(-1, self.d_model, self.eh, self.ew)
f = self.dec(f)
# The transposed-conv stack only lands exactly on (h, w) when both are
# multiples of 4 (true for the 10x10 grid, false for the 8x10 digit
# grid, where it produced 6 rows). Resize to the exact observation
# shape before the output head; this is a no-op when the stack already
# matches, so GridWorld results are unchanged.
if f.shape[-2] != self.h or f.shape[-1] != self.w:
f = F.interpolate(f, size=(self.h, self.w), mode="nearest")
return self.head(f)
def forward(self, x):
mu, lv = self.encode(x)
s = mu + torch.randn_like(mu) * (0.5 * lv).exp()
return self.decode(x if False else s), mu, lv
def recon_loss(logits, target, mode="flat", reduce=True):
"""Per-example categorical NLL.
The observation is one-hot by construction (one object cell for GridWorld,
one digit per position for Arithmetic), so the natural likelihood is a
softmax over the candidate cells -- and it is exactly the quantity whose
arg-max defines the paper's exact-match metric. Pixel-wise BCE is the
wrong likelihood here: with 99 background cells to 1 foreground it is
minimised by predicting all-background, which never learns the object.
"""
if mode == "flat":
l = F.cross_entropy(logits.flatten(1), target.flatten(1).argmax(1),
reduction="none")
else:
lp = logits[:, 0] # (N, H, W)
tgt = target[:, 0].argmax(-1) # (N, H)
l = F.cross_entropy(lp.reshape(-1, lp.shape[-1]), tgt.reshape(-1),
reduction="none").view(tgt.shape).mean(1)
return l.mean() if reduce else l
def to_obs(logits, mode="flat"):
"""Logits -> a normalised observation-shaped tensor (for state grounding)."""
if mode == "flat":
n, c, h, w = logits.shape
return F.softmax(logits.flatten(1), dim=1).view(n, c, h, w)
return F.softmax(logits, dim=-1)
def decode_index(logits, mode="flat"):
"""Argmax decoding to a discrete object identity for exact-match scoring."""
if mode == "flat":
return logits.flatten(1).argmax(1)
# "row": one active cell per row (digit string)
return logits[:, 0].argmax(-1) # (N, H)
# --------------------------------------------------------------------------
# FiLM-MLP building block
# --------------------------------------------------------------------------
class FiLMMLP(nn.Module):
"""FiLM-conditioned MLP.
The pretrained VAE latent has a large scale (||s|| ~ 19), which makes an
un-normalised FiLM layer produce gammas of order 10 and diverge. We
LayerNorm both the input and the conditioning stream; this is conditioning
hygiene, not a change to the method.
"""
def __init__(self, in_dim, cond_dim, out_dim, d_ff=128):
super().__init__()
self.ln_x = nn.LayerNorm(in_dim)
self.ln_c = nn.LayerNorm(cond_dim)
self.fc1 = nn.Linear(in_dim, d_ff)
self.film = nn.Linear(cond_dim, 2 * d_ff)
self.fc2 = nn.Linear(d_ff, d_ff)
self.out = nn.Linear(d_ff, out_dim)
def forward(self, x, cond):
h = self.fc1(self.ln_x(x))
gamma, beta = self.film(self.ln_c(cond)).chunk(2, dim=-1)
h = F.relu(h * (1 + gamma) + beta)
h = F.relu(self.fc2(h))
return self.out(h)
class VQ(nn.Module):
"""Vector quantiser with straight-through estimator and commitment loss."""
def __init__(self, n_codes, dim, commitment=0.25):
super().__init__()
self.emb = nn.Embedding(n_codes, dim)
nn.init.normal_(self.emb.weight, 0.0, 1.0) # matches LayerNormed inputs
self.commitment = commitment
self.n_codes = n_codes
def dists(self, z):
return (z.pow(2).sum(1, keepdim=True)
- 2 * z @ self.emb.weight.t()
+ self.emb.weight.pow(2).sum(1)[None, :])
def forward(self, z, idx=None):
d = self.dists(z)
if idx is None:
idx = d.argmin(1)
zq = self.emb(idx)
loss = F.mse_loss(zq, z.detach()) + self.commitment * F.mse_loss(z, zq.detach())
zq_st = z + (zq - z).detach()
return zq_st, idx, loss
def lookup(self, idx):
return self.emb(idx)
# --------------------------------------------------------------------------
# NEO
# --------------------------------------------------------------------------
class NEO(nn.Module):
def __init__(self, vae: ConvVAE, n_codes=6, action_dim=16, d_ff=128,
commitment=0.25, grounding=True):
super().__init__()
self.vae = vae
sd = vae.state_dim
self.policy = FiLMMLP(sd, sd, action_dim, d_ff) # q_phi(z | s_k, s_y)
self.pol_norm = nn.LayerNorm(action_dim) # bounded VQ inputs
self.transition = FiLMMLP(sd, action_dim, sd, d_ff) # f_theta(s, z)
self.vq = VQ(n_codes, action_dim, commitment)
self.grounding = grounding
# identity-initialised execution: s_{k+1} = s_k at step 0, so the
# rollout starts on the encoder manifold instead of drifting off it.
nn.init.zeros_(self.transition.out.weight)
nn.init.zeros_(self.transition.out.bias)
def step(self, s, z_q):
return s + self.transition(s, z_q) # residual execution
def rollout(self, s1, s_y, K, temperature=None, generator=None):
"""Unroll K steps. Returns states s_1..s_{K+1}, code indices, vq loss."""
s, states, codes, vq_loss = s1, [s1], [], 0.0
for _ in range(K):
a = self.pol_norm(self.policy(s, s_y))
if temperature is None:
zq, idx, l = self.vq(a)
else:
logits = -self.vq.dists(a) / temperature
probs = F.softmax(logits, dim=1)
idx = torch.multinomial(probs, 1, generator=generator).squeeze(1)
zq, idx, l = self.vq(a, idx=idx)
vq_loss = vq_loss + l
s = self.step(s, zq)
states.append(s)
codes.append(idx)
return states, torch.stack(codes, 1), vq_loss / max(K, 1)
def mdl_select(self, states, target, lam):
"""Eq. (4): k* = argmin_L lambda^L * loss(y, D(s_{L+1})), L in 0..K."""
mode = getattr(self.vae, "mode", "flat")
losses = torch.stack(
[recon_loss(self.vae.decode(s), target, mode, reduce=False)
for s in states], 1)
L = torch.arange(losses.shape[1], device=losses.device, dtype=losses.dtype)
scores = (lam ** L)[None, :] * losses
kstar = scores.argmin(1)
return kstar, losses
def grounding_loss(self, states):
if not self.grounding:
return torch.zeros((), device=states[0].device)
mode = getattr(self.vae, "mode", "flat")
tot = 0.0
for s in states[1:]: # intermediate + final states
with torch.no_grad():
anchor = self.vae.encode(to_obs(self.vae.decode(s), mode))[0]
d2 = (s - anchor).pow(2)
tot = tot + (d2.mean(1) if GROUNDING_MEAN else d2.sum(1)).mean()
return tot / max(len(states) - 1, 1)
# --------------------------------------------------------------------------
# Monolithic baselines
# --------------------------------------------------------------------------
class DiscMono(nn.Module):
"""Conditional VQ-VAE: the whole program is ONE quantised vector (LAPO/Genie)."""
def __init__(self, vae: ConvVAE, n_codes=36, action_dim=16, d_ff=128,
commitment=0.25):
super().__init__()
self.vae = vae
sd = vae.state_dim
self.infer = FiLMMLP(sd, sd, action_dim, d_ff)
self.inf_norm = nn.LayerNorm(action_dim)
self.transition = FiLMMLP(sd, action_dim, sd, d_ff)
self.vq = VQ(n_codes, action_dim, commitment)
nn.init.zeros_(self.transition.out.weight)
nn.init.zeros_(self.transition.out.bias)
def program(self, sx, sy):
a = self.inf_norm(self.infer(sx, sy))
zq, idx, l = self.vq(a)
return zq, idx, l
def apply(self, sx, zq):
return sx + self.transition(sx, zq)
class ContMono(nn.Module):
"""Conditional beta-VAE: the program is ONE continuous vector (AdaWorld)."""
def __init__(self, vae: ConvVAE, action_dim=16, d_ff=128, beta=0.01):
super().__init__()
self.vae = vae
sd = vae.state_dim
self.infer = FiLMMLP(sd, sd, 2 * action_dim, d_ff)
self.transition = FiLMMLP(sd, action_dim, sd, d_ff)
self.beta = beta
self.action_dim = action_dim
nn.init.zeros_(self.transition.out.weight)
nn.init.zeros_(self.transition.out.bias)
def program(self, sx, sy, sample=True):
mu, lv = self.infer(sx, sy).chunk(2, dim=-1)
lv = lv.clamp(-8, 8)
z = mu + torch.randn_like(mu) * (0.5 * lv).exp() if sample else mu
kl = (-0.5 * (1 + lv - mu.pow(2) - lv.exp())).sum(1).mean()
return z, kl
def apply(self, sx, z):
return sx + self.transition(sx, z)