Ticket #48413: Portfile 1.2

File Portfile 1.2, 2.1 KB (added by tczorro (Derrick), 6 years ago)

upload 09/16/2015

Line 
1# -*- 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
2# $Id$
3
4PortSystem          1.0
5PortGroup           python 1.0
6PortGroup           github 1.0
7PortGroup           active_variants 1.1
8
9github.setup        theochem horton 2.0.0
10name                horton
11version             2.0.0
12platforms           darwin
13license             GPL-3+
14categories-append   science
15maintainers         mcmaster.ca:yangx59
16
17description         HORTON is a quantum chemistry program written primarily in Python language.
18long_description    ${description} It can serve as a stand-alone program for electronic structure calculation (HF, DFT,\Geminals, PT)
19
20
21homepage            http://theochem.github.io/horton/
22checksums           rmd160  bb2536bb1af8f5335e523580b44bd1b5d95c0763 \
23                    sha256  7217637ebb36412a27fc09f08aba6e5859358fc670f440b8c3f959d45920c243
24
25python.default_version     27
26
27depends_lib         port:atlas \
28                    port:libint \
29                    port:py${python.default_version}-numpy \
30                    port:py${python.default_version}-h5py \
31                    port:py${python.default_version}-scipy \
32                    port:py${python.default_version}-cython \
33                    port:py${python.default_version}-nose \
34                    port:py${python.default_version}-sympy \
35                    port:py${python.default_version}-sphinx \
36                    port:py${python.default_version}-matplotlib \
37                    port:libxc
38
39pre-build {
40        system -W ${worksrcpath}/data/refatoms "make all"
41        copy ${worksrcpath}/data/setup_cfgs/setup.Darwin-macport-x86_64.cfg ${worksrcpath}/setup.cfg
42        reinplace "s|/opt/local|${prefix}|g" ${worksrcpath}/setup.cfg
43}
44
45post-destroot {
46    reinplace "s|${destroot}${prefix}|${prefix}|" ${destroot}${python.pkgd}/horton/data_dir.txt
47}
48
49pre-activate {
50    if {![active_variants py27-numpy atlas]} {
51        notes {In order to have CHOLESKY work properly, please install numpy +atlas manually with the following command: sudo port -n upgrade --enforce-variants py27-numpy +atlas}
52    }
53}
54
55livecheck.type        none