atmosiq-processed / scripts /tensor_prep.py
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r"""
tensor_prep.py -> builds ALL training tensors from train_ready (CPU, 64GB).
The GPU VM then just loads these + model.py and trains (no CPU prep there).
Dense layout: everything indexed by (day, node_pos). N=32,686 nodes fixed order.
Outputs to data/tensors/:
node_index.parquet node_id -> pos
dates.npy sorted unique YYYY-MM-DD
feat_cols.json ordered feature names
features.npy [DAYS,N,F] float16 (z-scored on TRAIN fold, NaN->0)
physics.npy [DAYS,N,3] float16 RAW u_1330ist,v_1330ist,blh (physics needs real units)
targets.npy [DAYS,N,7] float16 (raw pollutant values)
target_mask.npy [DAYS,N,7] uint8 (1 = observed & labeled)
edges.npz ei[2,E] positions, e_hat[E], n_hat[E]
node_split.npy [N] uint8 (0 train,1 val,2 test,3 buffer/none)
norm.npz mean,std per feature (train fold only)
Run: python data\models\tensor_prep.py
"""
from __future__ import annotations
import os, sys, json, pathlib
import numpy as np, pandas as pd
OUT = pathlib.Path(os.environ.get("ATMOS_OUT","data/ingest"))
GRID = pathlib.Path(os.environ.get("ATMOS_GRID","data/grid/grid_nodes.parquet"))
GRAPH = pathlib.Path(os.environ.get("ATMOS_GRAPH","data/graph"))
SPLIT = pathlib.Path(os.environ.get("ATMOS_SPLITS","data/splits"))/"spatial_split.parquet"
DEST = pathlib.Path(os.environ.get("ATMOS_TENSORS","data/tensors")); DEST.mkdir(parents=True, exist_ok=True)
TARGETS = ["pm2_5","pm10","no2","so2","co","o3","nh3"]
PHYS_COLS = ["u_1330ist","v_1330ist","era5_boundary_layer_height"]
META = set(["node_id","date","centroid_lat","centroid_lon","n_stations","labeled","split","block_id"]+TARGETS)
EDGE_FILE = os.environ.get("ATMOS_EDGES","graph_edges_static_r40_k8.parquet")
def main():
gn = pd.read_parquet(GRID)
pos = {nid:i for i,nid in enumerate(gn["node_id"].astype(str))}
N = len(pos); print(f"nodes: {N:,}")
pd.DataFrame({"node_id":list(pos), "pos":list(pos.values())}).to_parquet(DEST/"node_index.parquet", index=False)
# split -> per-node fold
sp = pd.read_parquet(SPLIT); fmap = {"train":0,"val":1,"test":2,"buffer":3}
nsplit = np.full(N, 3, np.uint8)
for nid, s in zip(sp.node_id.astype(str), sp.split): nsplit[pos[nid]] = fmap.get(s,3)
np.save(DEST/"node_split.npy", nsplit)
# edges -> positions + geometry
ed = pd.read_parquet(GRAPH/EDGE_FILE)
ei = np.stack([ed.src_node.astype(str).map(pos).values, ed.dst_node.astype(str).map(pos).values]).astype(np.int64)
np.savez(DEST/"edges.npz", ei=ei, e_hat=ed.e_hat.values.astype(np.float32), n_hat=ed.n_hat.values.astype(np.float32))
print(f"edges: {ei.shape[1]:,}")
# discover feature columns + all dates from partitions
parts = sorted((OUT/"train_ready").glob("*.parquet"))
f0 = pd.read_parquet(parts[0])
feat_cols = [c for c in f0.columns if c not in META and pd.api.types.is_numeric_dtype(f0[c])]
json.dump(feat_cols, open(DEST/"feat_cols.json","w"))
F = len(feat_cols); print(f"features: {F}")
dates = sorted(set().union(*[set(pd.read_parquet(p, columns=["date"]).date.astype(str)) for p in parts]))
didx = {d:i for i,d in enumerate(dates)}; D = len(dates)
np.save(DEST/"dates.npy", np.array(dates))
print(f"days: {D:,} -> feature array {D}x{N}x{F} float16 = {D*N*F*2/1e9:.1f} GB")
# dense arrays
A = np.full((D,N,F), np.nan, np.float32) # build in f32, cast at save
PH = np.full((D,N,3), np.nan, np.float32)
Y = np.full((D,N,7), np.nan, np.float32)
for p in parts:
df = pd.read_parquet(p)
di = df.date.astype(str).map(didx).values
ni = df.node_id.astype(str).map(pos).values
ok = ~pd.isna(di) & ~pd.isna(ni)
di = di[ok].astype(int); ni = ni[ok].astype(int); df = df[ok]
A[di, ni, :] = df[feat_cols].to_numpy(np.float32)
for j,c in enumerate(PHYS_COLS):
if c in df: PH[di, ni, j] = pd.to_numeric(df[c], errors="coerce").to_numpy(np.float32)
for j,c in enumerate(TARGETS):
Y[di, ni, j] = pd.to_numeric(df[c], errors="coerce").to_numpy(np.float32)
print(f" placed {p.stem}", end="\r")
print()
# normalization on TRAIN-fold node-days only (no leakage)
train_nodes = np.where(nsplit==0)[0]
sub = A[:, train_nodes, :].reshape(-1, F)
mean = np.nanmean(sub, 0); std = np.nanstd(sub, 0); std[std==0 | ~np.isfinite(std)] = 1.0
np.savez(DEST/"norm.npz", mean=mean.astype(np.float32), std=std.astype(np.float32), feat_cols=np.array(feat_cols))
A = (A - mean) / std
A = np.nan_to_num(A, nan=0.0) # NaN -> 0 (=mean); *_present flags carry missingness
PH = np.nan_to_num(PH, nan=0.0) # calm/zero where missing
mask = (~np.isnan(Y)).astype(np.uint8)
Y = np.nan_to_num(Y, nan=0.0)
np.save(DEST/"features.npy", A.astype(np.float16))
np.save(DEST/"physics.npy", PH.astype(np.float16))
np.save(DEST/"targets.npy", Y.astype(np.float16))
np.save(DEST/"target_mask.npy", mask)
lab_days = int((mask.sum(2)>0).sum())
print(f"saved tensors to {DEST} | labeled node-days: {lab_days:,}")
print(f" features {A.shape} physics {PH.shape} targets {Y.shape}")
if __name__ == "__main__": main()