gentoo-ebuilds/sci-chemistry/chemex/chemex-2025.4.0.ebuild
Pacho Ramos 0cbfa06340
sci-chemistry/chemex: add 2025.4.0
Signed-off-by: Pacho Ramos <pacho@gentoo.org>
2025-05-22 17:42:42 +02:00

40 lines
1.1 KiB
Bash

# Copyright 1999-2025 Gentoo Authors
# Distributed under the terms of the GNU General Public License v2
EAPI=8
DISTUTILS_SINGLE_IMPL="yes"
DISTUTILS_USE_PEP517=hatchling
PYTHON_COMPAT=( python3_{12..13} )
inherit distutils-r1 pypi
DESCRIPTION="Program to fit chemical exchange induced shift and relaxation data"
HOMEPAGE="https://github.com/gbouvignies/chemex https://pypi.org/project/chemex/"
LICENSE="BSD"
SLOT="0"
KEYWORDS="~amd64"
IUSE="test"
#RESTRICT="!test? ( test )"
# FIXME: Restrict until tests are readded https://github.com/gbouvignies/ChemEx/issues/51
RESTRICT="test"
RDEPEND="
$(python_gen_cond_dep '
>=dev-python/annotated-types-0.7.0[${PYTHON_USEDEP}]
>=dev-python/cachetools-5.5.1[${PYTHON_USEDEP}]
>=dev-python/emcee-3.1.6[${PYTHON_USEDEP}]
>=dev-python/lmfit-1.3.2[${PYTHON_USEDEP}]
>=dev-python/matplotlib-3.10.0[${PYTHON_USEDEP}]
>=dev-python/numpy-2.2.3[${PYTHON_USEDEP}]
>=dev-python/pydantic-2.10.6[${PYTHON_USEDEP}]
>=dev-python/rapidfuzz-3.12.1[${PYTHON_USEDEP}]
>=dev-python/rich-13.9.4[${PYTHON_USEDEP}]
>=dev-python/scipy-1.15.2[${PYTHON_USEDEP}]
')
"
DEPEND="${RDEPEND}"
distutils_enable_tests pytest