Commit 96f26ff8 authored by Wang, Leping's avatar Wang, Leping
Browse files

build(deps): add dependencies for submodules of FastEq and cuEquivariance

parent c6d077ba
......@@ -6,3 +6,11 @@
path = mace
url = ssh://git@10.208.16.64:2222/huafeng/MACE.git
branch = fasteq-mace-bench
[submodule "FastEq"]
path = FastEq
url = ssh://git@10.208.16.64:2222/ncic-ai4sci/FastEq.git
branch = hip
[submodule "cuequivariance_torch"]
path = cuequivariance_torch
url = git@github.com:malixian/cuEquivariance.git
branch = hip
FastEq @ 994aada0
Subproject commit 994aada0c1b9b55c36e7c48c33d1efbaae1e87de
Subproject commit a4ba77a7d8929f454f78b462ee6ddff306bc80d9
......@@ -18,11 +18,20 @@ dependencies = [
"tqdm==4.67.1",
"mace-torch",
"joblib>=1.5.3",
"cuequivariance-torch",
"fasteq>=0.1.0",
]
[tool.uv.sources]
torch = { path = "../whl/torch-2.5.1+das.opt1.dtk25042-cp310-cp310-manylinux_2_28_x86_64.whl" }
mace-torch = { path = "./mace", editable = true }
cuequivariance-torch = { path = "./cuequivariance_torch/cuequivariance_torch", editable = true }
fasteq = { path = "./FastEq", editable = true }
[tool.uv]
no-build-isolation-package = [
"fasteq",
]
[build-system]
requires = ["hatchling"]
......@@ -33,4 +42,5 @@ packages = ["basic_function", "mace-bench/src/batchopt"]
[tool.uv.extra-build-dependencies]
torch-scatter = ["torch"]
cuequivariance-torch = ["hatchling"]
......@@ -97,6 +97,8 @@ version = "0.1.0"
source = { editable = "." }
dependencies = [
{ name = "ase" },
{ name = "cuequivariance-torch" },
{ name = "fasteq" },
{ name = "joblib" },
{ name = "mace-torch" },
{ name = "networkx" },
......@@ -114,6 +116,8 @@ dependencies = [
[package.metadata]
requires-dist = [
{ name = "ase", specifier = "==3.23.0" },
{ name = "cuequivariance-torch", editable = "cuequivariance_torch/cuequivariance_torch" },
{ name = "fasteq", editable = "FastEq" },
{ name = "joblib", specifier = ">=1.5.3" },
{ name = "mace-torch", editable = "mace" },
{ name = "networkx", specifier = "==3.2.1" },
......@@ -204,6 +208,32 @@ wheels = [
{ url = "https://mirrors.bfsu.edu.cn/pypi/web/packages/8f/4d/5bb3192bbe9d3f27e3061a6a8e7733c9120e203cb8515767d30973f71030/contourpy-1.3.2-pp310-pypy310_pp73-win_amd64.whl", hash = "sha256:ded1706ed0c1049224531b81128efbd5084598f18d8a2d9efae833edbd2b40ad", size = 220599, upload-time = "2025-04-15T17:45:08.456Z" },
]
[[package]]
name = "cuequivariance"
version = "0.9.1"
source = { registry = "https://mirrors.bfsu.edu.cn/pypi/web/simple" }
dependencies = [
{ name = "networkx" },
{ name = "numpy" },
{ name = "opt-einsum" },
{ name = "scipy" },
{ name = "sympy" },
]
sdist = { url = "https://mirrors.bfsu.edu.cn/pypi/web/packages/04/33/d9bd6f1f70940fa657796db1ddb2efe5fffc9dc2cc415668970b95072161/cuequivariance-0.9.1.tar.gz", hash = "sha256:718936970beee9e3ea18a1aecdfb30b5915ab8abb9b2a81aeab004a82b3ea6f8", size = 238620, upload-time = "2026-03-16T17:25:35.185Z" }
wheels = [
{ url = "https://mirrors.bfsu.edu.cn/pypi/web/packages/25/70/7bfedcdd0223357930f5312c9ac5d6cc5fea88b73372c4087ffc3655a9e3/cuequivariance-0.9.1-py3-none-any.whl", hash = "sha256:9560813c90f2d530b9860a61a5e39e808a95a6345e9cc9768ea01e78de3a7c1e", size = 269242, upload-time = "2026-03-16T17:25:34.138Z" },
]
[[package]]
name = "cuequivariance-torch"
source = { editable = "cuequivariance_torch/cuequivariance_torch" }
dependencies = [
{ name = "cuequivariance" },
]
[package.metadata]
requires-dist = [{ name = "cuequivariance" }]
[[package]]
name = "cycler"
version = "0.12.1"
......@@ -228,6 +258,11 @@ wheels = [
{ url = "https://mirrors.bfsu.edu.cn/pypi/web/packages/9a/b6/c8327065d1dd8bca28521fe65ff72b649ed17ca8a1f0c1f498006d7567b7/e3nn-0.4.4-py3-none-any.whl", hash = "sha256:87d99876abb362a6e07d555d10752ff2e20c2b7731d8928ebe5d9121fb019f84", size = 387707, upload-time = "2021-12-16T08:49:21.596Z" },
]
[[package]]
name = "fasteq"
version = "0.1.0"
source = { editable = "FastEq" }
[[package]]
name = "filelock"
version = "3.25.2"
......
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