Files
dmlc--dgl/examples/pytorch/graphsim/train.py
T
2026-07-13 13:35:51 +08:00

252 lines
7.6 KiB
Python

import argparse
import time
import traceback
import dgl
import networkx as nx
import numpy as np
import torch
from dataloader import (
MultiBodyGraphCollator,
MultiBodyTestDataset,
MultiBodyTrainDataset,
MultiBodyValidDataset,
)
from models import InteractionNet, MLP, PrepareLayer
from torch.utils.data import DataLoader
from utils import make_video
def train(
optimizer, loss_fn, reg_fn, model, prep, dataloader, lambda_reg, device
):
total_loss = 0
model.train()
for i, (graph_batch, data_batch, label_batch) in enumerate(dataloader):
graph_batch = graph_batch.to(device)
data_batch = data_batch.to(device)
label_batch = label_batch.to(device)
optimizer.zero_grad()
node_feat, edge_feat = prep(graph_batch, data_batch)
dummy_relation = torch.zeros(edge_feat.shape[0], 1).float().to(device)
dummy_global = torch.zeros(node_feat.shape[0], 1).float().to(device)
v_pred, out_e = model(
graph_batch,
node_feat[:, 3:5].float(),
edge_feat.float(),
dummy_global,
dummy_relation,
)
loss = loss_fn(v_pred, label_batch)
total_loss += float(loss)
zero_target = torch.zeros_like(out_e)
loss = loss + lambda_reg * reg_fn(out_e, zero_target)
reg_loss = 0
for param in model.parameters():
reg_loss = reg_loss + lambda_reg * reg_fn(
param, torch.zeros_like(param).float().to(device)
)
loss = loss + reg_loss
loss.backward()
optimizer.step()
return total_loss / (i + 1)
# One step evaluation
def eval(loss_fn, model, prep, dataloader, device):
total_loss = 0
model.eval()
for i, (graph_batch, data_batch, label_batch) in enumerate(dataloader):
graph_batch = graph_batch.to(device)
data_batch = data_batch.to(device)
label_batch = label_batch.to(device)
node_feat, edge_feat = prep(graph_batch, data_batch)
dummy_relation = torch.zeros(edge_feat.shape[0], 1).float().to(device)
dummy_global = torch.zeros(node_feat.shape[0], 1).float().to(device)
v_pred, _ = model(
graph_batch,
node_feat[:, 3:5].float(),
edge_feat.float(),
dummy_global,
dummy_relation,
)
loss = loss_fn(v_pred, label_batch)
total_loss += float(loss)
return total_loss / (i + 1)
# Rollout Evaluation based in initial state
# Need to integrate
def eval_rollout(model, prep, initial_frame, n_object, device):
current_frame = initial_frame.to(device)
base_graph = nx.complete_graph(n_object)
graph = dgl.from_networkx(base_graph).to(device)
pos_buffer = []
model.eval()
for step in range(100):
node_feats, edge_feats = prep(graph, current_frame)
dummy_relation = torch.zeros(edge_feats.shape[0], 1).float().to(device)
dummy_global = torch.zeros(node_feats.shape[0], 1).float().to(device)
v_pred, _ = model(
graph,
node_feats[:, 3:5].float(),
edge_feats.float(),
dummy_global,
dummy_relation,
)
current_frame[:, [1, 2]] += v_pred * 0.001
current_frame[:, 3:5] = v_pred
pos_buffer.append(current_frame[:, [1, 2]].cpu().numpy())
pos_buffer = np.vstack(pos_buffer).reshape(100, n_object, -1)
make_video(pos_buffer, "video_model.mp4")
if __name__ == "__main__":
argparser = argparse.ArgumentParser()
argparser.add_argument(
"--lr", type=float, default=0.001, help="learning rate"
)
argparser.add_argument(
"--epochs", type=int, default=40000, help="Number of epochs in training"
)
argparser.add_argument(
"--lambda_reg", type=float, default=0.001, help="regularization weight"
)
argparser.add_argument(
"--gpu", type=int, default=-1, help="gpu device code, -1 means cpu"
)
argparser.add_argument(
"--batch_size", type=int, default=100, help="size of each mini batch"
)
argparser.add_argument(
"--num_workers",
type=int,
default=0,
help="number of workers for dataloading",
)
argparser.add_argument(
"--visualize",
action="store_true",
default=False,
help="Whether enable trajectory rollout mode for visualization",
)
args = argparser.parse_args()
# Select Device to be CPU or GPU
if args.gpu != -1:
device = torch.device("cuda:{}".format(args.gpu))
else:
device = torch.device("cpu")
train_data = MultiBodyTrainDataset()
valid_data = MultiBodyValidDataset()
test_data = MultiBodyTestDataset()
collator = MultiBodyGraphCollator(train_data.n_particles)
train_dataloader = DataLoader(
train_data,
args.batch_size,
True,
collate_fn=collator,
num_workers=args.num_workers,
)
valid_dataloader = DataLoader(
valid_data,
args.batch_size,
True,
collate_fn=collator,
num_workers=args.num_workers,
)
test_full_dataloader = DataLoader(
test_data,
args.batch_size,
True,
collate_fn=collator,
num_workers=args.num_workers,
)
node_feats = 5
stat = {
"median": torch.from_numpy(train_data.stat_median).to(device),
"max": torch.from_numpy(train_data.stat_max).to(device),
"min": torch.from_numpy(train_data.stat_min).to(device),
}
print(
"Weight: ",
train_data.stat_median[0],
train_data.stat_max[0],
train_data.stat_min[0],
)
print(
"Position: ",
train_data.stat_median[[1, 2]],
train_data.stat_max[[1, 2]],
train_data.stat_min[[1, 2]],
)
print(
"Velocity: ",
train_data.stat_median[[3, 4]],
train_data.stat_max[[3, 4]],
train_data.stat_min[[3, 4]],
)
prepare_layer = PrepareLayer(node_feats, stat).to(device)
interaction_net = InteractionNet(node_feats, stat).to(device)
print(interaction_net)
optimizer = torch.optim.Adam(interaction_net.parameters(), lr=args.lr)
state_dict = interaction_net.state_dict()
loss_fn = torch.nn.MSELoss()
reg_fn = torch.nn.MSELoss(reduction="sum")
try:
for e in range(args.epochs):
last_t = time.time()
loss = train(
optimizer,
loss_fn,
reg_fn,
interaction_net,
prepare_layer,
train_dataloader,
args.lambda_reg,
device,
)
print("Epoch time: ", time.time() - last_t)
if e % 1 == 0:
valid_loss = eval(
loss_fn,
interaction_net,
prepare_layer,
valid_dataloader,
device,
)
test_full_loss = eval(
loss_fn,
interaction_net,
prepare_layer,
test_full_dataloader,
device,
)
print(
"Epoch: {}.Loss: Valid: {} Full: {}".format(
e, valid_loss, test_full_loss
)
)
except:
traceback.print_exc()
finally:
if args.visualize:
eval_rollout(
interaction_net,
prepare_layer,
test_data.first_frame,
test_data.n_particles,
device,
)
make_video(test_data.test_traj[:100, :, [1, 2]], "video_truth.mp4")