# -*- coding: utf-8; mode: tcl; tab-width: 4; indent-tabs-mode: nil; c-basic-offset: 4 -*- vim:fenc=utf-8:ft=tcl:et:sw=4:ts=4:sts=4

PortSystem          1.0
PortGroup           python 1.0

name                chemex
version             2024.5.2
revision            0

categories-prepend  science
supported_archs     noarch
platforms           {darwin any}
license             GPL-3+
maintainers         {reneeotten @reneeotten} openmaintainer

description         ChemEx is an analysis program for chemical exchange detected by NMR
long_description    {*}${description}

homepage            https://github.com/gbouvignies/chemex

checksums           rmd160  a97076424d3155fd769d07090cdbb4a3bd20fccb \
                    sha256  bc0ba982acd18902f60a6244cf8eee49f116346790038ac5ee8ff1346b08ef1b \
                    size    103494

python.default_version 312
python.pep517_backend

depends_build-append \
                    port:py${python.version}-pdm-backend

depends_lib-append  port:py${python.version}-annotated_types \
                    port:py${python.version}-cachetools \
                    port:py${python.version}-emcee3 \
                    port:py${python.version}-lmfit \
                    port:py${python.version}-matplotlib \
                    port:py${python.version}-numdifftools \
                    port:py${python.version}-numpy \
                    port:py${python.version}-pydantic \
                    port:py${python.version}-rapidfuzz \
                    port:py${python.version}-rich \
                    port:py${python.version}-scipy