# -*- 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                py-xyzgraph
version             1.6.12
revision            0

categories-append   science
platforms           {darwin any}
supported_archs     noarch
license             MIT
maintainers         {reneeotten @reneeotten} openmaintainer

description         Molecular Graph Construction from Cartesian Coordinates.
long_description    {*}${description}

homepage            https://github.com/aligfellow/xyzgraph

checksums           rmd160  7ab664796982d1c50293c722aa3524c95d9078c5 \
                    sha256  7f4dfe30538d18ccba38c23c3741e10fe8e1089e058f0db753e798240c36de7f \
                    size    175875

python.versions     314

if {${name} ne ${subport}} {
    depends_lib-append \
                    port:py${python.version}-networkx \
                    port:py${python.version}-numpy \
                    port:rdkit

    test.run        yes
}