[FEA] cuGraph GNN NCCL-only Setup and Distributed Sampling

ci/run_cugraph_pyg_pytests.sh

@@ -11,5 +11,5 @@ pytest --cache-clear --ignore=tests/mg "$@" .
 # Test examples
 for e in "$(pwd)"/examples/*.py; do
   rapids-logger "running example $e"
-  python $e
+  (yes || true) | python $e
 done

ci/test_wheel_cugraph-pyg.sh

@@ -52,6 +52,6 @@ python -m pytest \
 # Test examples
 for e in "$(pwd)"/examples/*.py; do
   rapids-logger "running example $e"
-  python $e
+  (yes || true) | python $e
 done
 popd

python/cugraph-pyg/cugraph_pyg/examples/cugraph_dist_sampling_mg.py

@@ -0,0 +1,112 @@
+# Copyright (c) 2024, NVIDIA CORPORATION.
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#     http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+# This example shows how to use cuGraph nccl-only comms, pylibcuGraph,
+# and PyTorch DDP to run a multi-GPU sampling workflow.  Most users of the
+# GNN packages will not interact with cuGraph directly.  This example
+# is intented for users who want to extend cuGraph within a DDP workflow.
+
+import os
+import re
+import tempfile
+
+import numpy as np
+import torch
+import torch.multiprocessing as tmp
+import torch.distributed as dist
+
+import cudf
+
+from cugraph.gnn import (
+    cugraph_comms_init,
+    cugraph_comms_shutdown,
+    cugraph_comms_create_unique_id,
+    cugraph_comms_get_raft_handle,
+    DistSampleWriter,
+    UniformNeighborSampler,
+)
+
+from pylibcugraph import MGGraph, ResourceHandle, GraphProperties
+
+from ogb.nodeproppred import NodePropPredDataset
+
+
+def init_pytorch(rank, world_size):
+    os.environ["MASTER_ADDR"] = "localhost"
+    os.environ["MASTER_PORT"] = "12355"
+    dist.init_process_group("nccl", rank=rank, world_size=world_size)
+
+
+def sample(rank: int, world_size: int, uid, edgelist, directory):
+    init_pytorch(rank, world_size)
+
+    device = rank
+    cugraph_comms_init(rank, world_size, uid, device)
+
+    print(f"rank {rank} initialized cugraph")
+
+    src = cudf.Series(np.array_split(edgelist[0], world_size)[rank])
+    dst = cudf.Series(np.array_split(edgelist[1], world_size)[rank])
+
+    seeds_per_rank = 50
+    seeds = cudf.Series(np.arange(rank * seeds_per_rank, (rank + 1) * seeds_per_rank))
+    handle = ResourceHandle(cugraph_comms_get_raft_handle().getHandle())
+
+    print("constructing graph")
+    G = MGGraph(
+        handle,
+        GraphProperties(is_multigraph=True, is_symmetric=False),
+        [src],
+        [dst],
+    )
+    print("graph constructed")
+
+    sample_writer = DistSampleWriter(directory=directory, batches_per_partition=2)
+    sampler = UniformNeighborSampler(
+        G,
+        sample_writer,
+        fanout=[5, 5],
+    )
+
+    sampler.sample_from_nodes(seeds, batch_size=16, random_state=62)
+
+    dist.barrier()
+    cugraph_comms_shutdown()
+    print(f"rank {rank} shut down cugraph")
+
+
+def main():
+    world_size = torch.cuda.device_count()
+    uid = cugraph_comms_create_unique_id()
+
+    dataset = NodePropPredDataset("ogbn-products")
+    el = dataset[0][0]["edge_index"].astype("int64")
+
+    with tempfile.TemporaryDirectory() as directory:
+        tmp.spawn(
+            sample,
+            args=(world_size, uid, el, "."),
+            nprocs=world_size,
+        )
+
+        print("Printing samples...")
+        for file in os.listdir(directory):
+            m = re.match(r"batch=([0-9]+)\.([0-9]+)\-([0-9]+)\.([0-9]+)\.parquet", file)
+            rank, start, _, end = int(m[1]), int(m[2]), int(m[3]), int(m[4])
+            print(f"File: {file} (batches {start} to {end} for rank {rank})")
+            print(cudf.read_parquet(os.path.join(directory, file)))
+            print("\n")
+
+
+if __name__ == "__main__":
+    main()

python/cugraph-pyg/cugraph_pyg/examples/cugraph_dist_sampling_sg.py

@@ -0,0 +1,80 @@
+# Copyright (c) 2024, NVIDIA CORPORATION.
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#     http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+# This example shows how to use cuGraph nccl-only comms, pylibcuGraph,
+# and PyTorch to run a single-GPU sampling workflow.  Most users of the
+# GNN packages will not interact with cuGraph directly.  This example
+# is intented for users who want to extend cuGraph within a PyTorch workflow.
+
+import os
+import re
+import tempfile
+
+import numpy as np
+
+import cudf
+
+from cugraph.gnn import (
+    DistSampleWriter,
+    UniformNeighborSampler,
+)
+
+from pylibcugraph import SGGraph, ResourceHandle, GraphProperties
+
+from ogb.nodeproppred import NodePropPredDataset
+
+
+def sample(edgelist, directory):
+    src = cudf.Series(edgelist[0])
+    dst = cudf.Series(edgelist[1])
+
+    seeds_per_rank = 50
+    seeds = cudf.Series(np.arange(0, seeds_per_rank))
+
+    print("constructing graph")
+    G = SGGraph(
+        ResourceHandle(),
+        GraphProperties(is_multigraph=True, is_symmetric=False),
+        src,
+        dst,
+    )
+    print("graph constructed")
+
+    sample_writer = DistSampleWriter(directory=directory, batches_per_partition=2)
+    sampler = UniformNeighborSampler(
+        G,
+        sample_writer,
+        fanout=[5, 5],
+    )
+
+    sampler.sample_from_nodes(seeds, batch_size=16, random_state=62)
+
+
+def main():
+    dataset = NodePropPredDataset("ogbn-products")
+    el = dataset[0][0]["edge_index"].astype("int64")
+
+    with tempfile.TemporaryDirectory() as directory:
+        sample(el, directory)
+
+        print("Printing samples...")
+        for file in os.listdir(directory):
+            m = re.match(r"batch=([0-9]+)\.([0-9]+)\-([0-9]+)\.([0-9]+)\.parquet", file)
+            rank, start, _, end = int(m[1]), int(m[2]), int(m[3]), int(m[4])
+            print(f"File: {file} (batches {start} to {end} for rank {rank})")
+            print(cudf.read_parquet(os.path.join(directory, file)))
+            print("\n")
+
+
+if __name__ == "__main__":
+    main()

python/cugraph-pyg/cugraph_pyg/examples/pylibcugraph_mg.py

@@ -0,0 +1,100 @@
+# Copyright (c) 2024, NVIDIA CORPORATION.
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#     http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+# This example shows how to use cuGraph nccl-only comms, pylibcuGraph,
+# and PyTorch DDP to run a multi-GPU workflow.  Most users of the
+# GNN packages will not interact with cuGraph directly.  This example
+# is intented for users who want to extend cuGraph within a DDP workflow.
+
+import os
+
+import pandas
+import numpy as np
+import torch
+import torch.multiprocessing as tmp
+import torch.distributed as dist
+
+import cudf
+
+from cugraph.gnn import (
+    cugraph_comms_init,
+    cugraph_comms_shutdown,
+    cugraph_comms_create_unique_id,
+    cugraph_comms_get_raft_handle,
+)
+
+from pylibcugraph import MGGraph, ResourceHandle, GraphProperties, degrees
+
+from ogb.nodeproppred import NodePropPredDataset
+
+
+def init_pytorch(rank, world_size):
+    os.environ["MASTER_ADDR"] = "localhost"
+    os.environ["MASTER_PORT"] = "12355"
+    dist.init_process_group("nccl", rank=rank, world_size=world_size)
+
+
+def calc_degree(rank: int, world_size: int, uid, edgelist):
+    init_pytorch(rank, world_size)
+
+    device = rank
+    cugraph_comms_init(rank, world_size, uid, device)
+
+    print(f"rank {rank} initialized cugraph")
+
+    src = cudf.Series(np.array_split(edgelist[0], world_size)[rank])
+    dst = cudf.Series(np.array_split(edgelist[1], world_size)[rank])
+
+    seeds = cudf.Series(np.arange(rank * 50, (rank + 1) * 50))
+    handle = ResourceHandle(cugraph_comms_get_raft_handle().getHandle())
+
+    print("constructing graph")
+    G = MGGraph(
+        handle,
+        GraphProperties(is_multigraph=True, is_symmetric=False),
+        [src],
+        [dst],
+    )
+    print("graph constructed")
+
+    print("calculating degrees")
+    vertices, in_deg, out_deg = degrees(handle, G, seeds, do_expensive_check=False)
+    print("degrees calculated")
+
+    print("constructing dataframe")
+    df = pandas.DataFrame(
+        {"v": vertices.get(), "in": in_deg.get(), "out": out_deg.get()}
+    )
+    print(df)
+
+    dist.barrier()
+    cugraph_comms_shutdown()
+    print(f"rank {rank} shut down cugraph")
+
+
+def main():
+    world_size = torch.cuda.device_count()
+    uid = cugraph_comms_create_unique_id()
+
+    dataset = NodePropPredDataset("ogbn-products")
+    el = dataset[0][0]["edge_index"].astype("int64")
+
+    tmp.spawn(
+        calc_degree,
+        args=(world_size, uid, el),
+        nprocs=world_size,
+    )
+
+
+if __name__ == "__main__":
+    main()

python/cugraph-pyg/cugraph_pyg/examples/pylibcugraph_sg.py

@@ -0,0 +1,66 @@
+# Copyright (c) 2024, NVIDIA CORPORATION.
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#     http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+# This example shows how to use cuGraph and pylibcuGraph to run a
+# single-GPU workflow.  Most users of the GNN packages will not interact
+# with cuGraph directly.  This example is intented for users who want
+# to extend cuGraph within a PyTorch workflow.
+
+import pandas
+import numpy as np
+
+import cudf
+
+from pylibcugraph import SGGraph, ResourceHandle, GraphProperties, degrees
+
+from ogb.nodeproppred import NodePropPredDataset
+
+
+def calc_degree(edgelist):
+    src = cudf.Series(edgelist[0])
+    dst = cudf.Series(edgelist[1])
+
+    seeds = cudf.Series(np.arange(256))
+
+    print("constructing graph")
+    G = SGGraph(
+        ResourceHandle(),
+        GraphProperties(is_multigraph=True, is_symmetric=False),
+        src,
+        dst,
+    )
+    print("graph constructed")
+
+    print("calculating degrees")
+    vertices, in_deg, out_deg = degrees(
+        ResourceHandle(), G, seeds, do_expensive_check=False
+    )
+    print("degrees calculated")
+
+    print("constructing dataframe")
+    df = pandas.DataFrame(
+        {"v": vertices.get(), "in": in_deg.get(), "out": out_deg.get()}
+    )
+    print(df)
+
+    print("done")
+
+
+def main():
+    dataset = NodePropPredDataset("ogbn-products")
+    el = dataset[0][0]["edge_index"].astype("int64")
+    calc_degree(el)
+
+
+if __name__ == "__main__":
+    main()

python/cugraph/cugraph/gnn/__init__.py

@@ -1,4 +1,4 @@
-# Copyright (c) 2022-2023, NVIDIA CORPORATION.
+# Copyright (c) 2022-2024, NVIDIA CORPORATION.
 # Licensed under the Apache License, Version 2.0 (the "License");
 # you may not use this file except in compliance with the License.
 # You may obtain a copy of the License at
@@ -13,3 +13,14 @@
 
 from .feature_storage.feat_storage import FeatureStore
 from .data_loading.bulk_sampler import BulkSampler
+from .data_loading.dist_sampler import (
+    DistSampler,
+    DistSampleWriter,
+    UniformNeighborSampler,
+)
+from .comms.cugraph_nccl_comms import (
+    cugraph_comms_init,
+    cugraph_comms_shutdown,
+    cugraph_comms_create_unique_id,
+    cugraph_comms_get_raft_handle,
+)