diff options
Diffstat (limited to 'sci-chemistry/chemex')
| -rw-r--r-- | sci-chemistry/chemex/Manifest | 2 | ||||
| -rw-r--r-- | sci-chemistry/chemex/chemex-2022.3.4.ebuild | 42 |
2 files changed, 44 insertions, 0 deletions
diff --git a/sci-chemistry/chemex/Manifest b/sci-chemistry/chemex/Manifest index 98886530fb31..3c2e0b2db476 100644 --- a/sci-chemistry/chemex/Manifest +++ b/sci-chemistry/chemex/Manifest @@ -1,7 +1,9 @@ DIST chemex-2022.3.0.tar.gz 2842921 BLAKE2B d0fe809ed64ee86ef319bd76c33dea1e75de13fc7cdf7e77d8cb74e4c76b66edd6e3c535df405a66bfc228780f34ee18a56639241ae8c234ac4128ed4ba806f3 SHA512 93a8e362ec024a3d49e2792e485b3a7808944fb02c41dae0d0b2af14ccb00b95d9edddc47eef0f08d1040b08cf6078be74b45185be84b495ead96c951ee52515 DIST chemex-2022.3.1.tar.gz 2845188 BLAKE2B dbc6c73f1c8702a027c647b6c9a64a00a0ba5ce64edddd16fc68062b3bc4cff95f4c643d57b28d74f3bcda7b24ab99ce9bc28baad950b9cca1356e6b8a36be17 SHA512 f398a3402e11157950b599325c2152a2b47221cb2b926510fd4494554399aaf404de871c83f23fff86be8124e1151903cb6378c118fdecec55f4110cdbf74647 DIST chemex-2022.3.3.tar.gz 2845363 BLAKE2B 66912797480ceab3c4010c6c90f26e3cbb134d9b0f06fee35f46e22571ddd6cd30f2a65097d883ced7a2617c4034e5ac19caf76213f188465c791152087d3a32 SHA512 62023b86eb8c61365e09deeacd4c5e50c62897a814d7cfc99ec9fb3bb6a152f70fa387b4ea541eb7e3093149168811b1e9dd9177df9d893f612190b006c335dc +DIST chemex-2022.3.4.tar.gz 2845201 BLAKE2B 91a76bdb54857710d482b14e36d24adec8706c385da7300d8cf7189426af28651877d487eb061e26656432575eb711de0e3a92724d1488d99efcdc8a682b59bd SHA512 304af730149a2f6723bbe36c0deafb826392cd571a2b4245bb42e28612ceef3ee2ca989f1909ddc7709081f742a997469565ef7d02994fda8087372f29e1dfe1 EBUILD chemex-2022.3.0.ebuild 1251 BLAKE2B ca114ddd2d001cc8483f03bbf6e360d4e6f9c43c3fc013728a8691b4e220f81bbcda5ea7285502b7def50c8e2adcb57a10a536e27901b0da78d93f0e22eee1e7 SHA512 14dbbfd46838fb85a476328648c7eb5ef02909279f65f88ba8c4169991c0fdc6c84bafe526aac2f1046dcf4701fc34853573e1c0c8d041738852976326bc4731 EBUILD chemex-2022.3.1.ebuild 1251 BLAKE2B 5ead04345849a34fabfed3f675d5b0112853725206c208582ac55e0f3445a6cb32b449984da0c77f3aa466d8f5fcf70126c876e44bb9d5af71fb27beb8915438 SHA512 a088244bb017102b627b0dc8dc8a511a8cd2d8e26ecaf8b1b4358e707876c4bb927908844c57b132c99cacf6aa0c16a1982502883dd2bda63066d6f6bd600a9a EBUILD chemex-2022.3.3.ebuild 1250 BLAKE2B e6af845a61c59bc318e985d4e0b335aa526d426ff5186d07455768d2cf03e2ae6cdfd128fad40da16d33c13aba6dee6bf52f18e9eaeca9d2ddf8288312f3366a SHA512 b19b3336e0ac78b877463bc2431fb1daa57d5070444785ca47691cf21174b27277b3c41b49b136c18893a89015caab111edbb65b6a3dd1c90310f96388a85fdd +EBUILD chemex-2022.3.4.ebuild 1250 BLAKE2B e6af845a61c59bc318e985d4e0b335aa526d426ff5186d07455768d2cf03e2ae6cdfd128fad40da16d33c13aba6dee6bf52f18e9eaeca9d2ddf8288312f3366a SHA512 b19b3336e0ac78b877463bc2431fb1daa57d5070444785ca47691cf21174b27277b3c41b49b136c18893a89015caab111edbb65b6a3dd1c90310f96388a85fdd MISC metadata.xml 300 BLAKE2B a1ad769918094ddbda13ac92462ec69fa469dfcacde1202c653a4aa7443db661ffa5739cd039b6e38b13f0345a2680f276b4e071362106b162c95cd92007b5a8 SHA512 755c273f6bf67f79c388d06d970702a1d4a9f84338f8d889dd9146905c6994621917952225406ffba5bfe1e1b69f0bfd0f471374178b15343f4927af9de49aef diff --git a/sci-chemistry/chemex/chemex-2022.3.4.ebuild b/sci-chemistry/chemex/chemex-2022.3.4.ebuild new file mode 100644 index 000000000000..3df32b1ac247 --- /dev/null +++ b/sci-chemistry/chemex/chemex-2022.3.4.ebuild @@ -0,0 +1,42 @@ +# Copyright 1999-2023 Gentoo Authors +# Distributed under the terms of the GNU General Public License v2 + +EAPI=8 + +DISTUTILS_SINGLE_IMPL="yes" +DISTUTILS_USE_PEP517=poetry +PYTHON_COMPAT=( python3_{9..11} ) + +inherit distutils-r1 + +DESCRIPTION="Program to fit chemical exchange induced shift and relaxation data" +HOMEPAGE="https://github.com/gbouvignies/chemex" +SRC_URI="https://github.com/gbouvignies/ChemEx/archive/refs/tags/v${PV/_p/-dev}.tar.gz -> ${P}.tar.gz" +S="${WORKDIR}/ChemEx-${PV/_p/-dev}" + +SLOT="0" +LICENSE="BSD" +KEYWORDS="~amd64" +IUSE="test" + +#RESTRICT="!test? ( test )" +# FIXME: Restrict until tests are readded https://github.com/gbouvignies/ChemEx/issues/51 +RESTRICT="test" + +RDEPEND=" + $(python_gen_cond_dep ' + >=dev-python/asteval-0.9.25[${PYTHON_USEDEP}] + >=dev-python/cachetools-5.3.0[${PYTHON_USEDEP}] + >=dev-python/lmfit-1.2.0[${PYTHON_USEDEP}] + >=dev-python/matplotlib-3.7.1[${PYTHON_USEDEP}] + >=dev-python/numpy-1.24.2[${PYTHON_USEDEP}] + >=dev-python/pydantic-1.10.7[${PYTHON_USEDEP}] + >=dev-python/rapidfuzz-3.0.0[${PYTHON_USEDEP}] + >=dev-python/rich-13.3.4[${PYTHON_USEDEP}] + >=dev-python/scipy-1.10.1[${PYTHON_USEDEP}] + >=dev-python/tomli-2.0.1[${PYTHON_USEDEP}] + ') +" +DEPEND="${RDEPEND}" + +distutils_enable_tests pytest |