Skip to content

Commit fa25eb8

Browse files
adamwitmerajwitmer
andauthored
py-pysmiles: new package (spack#1932)
--------- Co-authored-by: Adam <[email protected]>
1 parent 78b00ae commit fa25eb8

File tree

1 file changed

+23
-0
lines changed
  • repos/spack_repo/builtin/packages/py_pysmiles

1 file changed

+23
-0
lines changed
Lines changed: 23 additions & 0 deletions
Original file line numberDiff line numberDiff line change
@@ -0,0 +1,23 @@
1+
# Copyright Spack Project Developers. See COPYRIGHT file for details.
2+
#
3+
# SPDX-License-Identifier: (Apache-2.0 OR MIT)
4+
5+
from spack_repo.builtin.build_systems.python import PythonPackage
6+
7+
from spack.package import *
8+
9+
10+
class PyPysmiles(PythonPackage):
11+
"""A lightweight Python-only library for reading and writing SMILES strings."""
12+
13+
homepage = "https://github.com/pckroon/pysmiles"
14+
pypi = "pysmiles/pysmiles-2.0.0.tar.gz"
15+
16+
license("Apache-2.0")
17+
maintainers("adamwitmer")
18+
19+
version("2.0.0", sha256="9bd1da9bf172fc79f71d647d21bbba34178702c664ae0778e59b4d4d149cbe4d")
20+
21+
depends_on("py-networkx", type=("build", "run"))
22+
depends_on("[email protected]:", type="build")
23+
depends_on("py-pbr", type=("build", "run"))

0 commit comments

Comments
 (0)