# This file created by conda-build 3.15.1
# meta.yaml template originally from:
# C:\projects\rdkit-feedstock\recipe, last modified Thu Jan 10 21:46:00 2019
# ------------------------------------------------

package:
    name: rdkit
    version: 2018.09.1
source:
    fn: Release_2018_09_1.tar.gz
    patches:
        - vs2015.patch
    sha256: 61c14652a05a6f6b216ff099381c4dd32048861ba9d96f75a017084e81848baa
    url: https://github.com/rdkit/rdkit/archive/Release_2018_09_1.tar.gz
build:
    number: '1001'
    string: py37h3020836_1001
requirements:
    build:
        - cmake 3.13.2 he025d50_1000
        - jom 1.1.3 0
        - vs2015_runtime 14.0.25420 0
        - vs2015_win-64 14.0.25123 h17c34da_3
    host:
        - blas 1.0 mkl
        - boost 1.68.0 py37hf75dd32_1001
        - boost-cpp 1.68.0 h6a4c333_1000
        - cairo 1.16.0 hc1b38c8_1000
        - eigen 3.3.7 he980bc4_1000
        - freetype 2.9.1 he8b6a0d_1004
        - icc_rt 2019.0.0 h0cc432a_1
        - icu 58.2 vc14_0
        - intel-openmp 2019.1 144
        - jpeg 9c hfa6e2cd_1001
        - libpng 1.6.36 h7602738_1000
        - libtiff 4.0.10 h36446d0_1001
        - mkl 2019.1 144
        - numpy 1.11.3 py37h0aa5519_11
        - numpy-base 1.11.3 py37h2a9b21d_11
        - olefile 0.46 py_0
        - pandas 0.23.4 py37h830ac7b_1000
        - pillow 5.4.1 py37h9a613e6_1000
        - pixman 0.34.0 hfa6e2cd_1003
        - python 3.7.1 hc182675_1000
        - python-dateutil 2.7.5 py_0
        - pytz 2018.9 py_0
        - six 1.12.0 py37_1000
        - tk 8.6.9 hfa6e2cd_1000
        - vc 14 0
        - vs2015_runtime 14.0.25420 0
        - zlib 1.2.11 h2fa13f4_1004
    run:
        - boost >=1.68.0,<1.68.1.0a0
        - cairo >=1.16.0,<1.17.0a0
        - cairo >=1.16.0,<1.17.0a0
        - freetype >=2.9.1,<3.0a0
        - numpy >=1.11.3,<2.0a0
        - pandas
        - pillow
        - pycairo
        - python >=3.7,<3.8.0a0
        - six
        - vc 14.*
test:
    imports:
        - rdkit
        - rdkit.Avalon
        - rdkit.Chem
        - rdkit.Chem.AllChem
        - rdkit.DataManip
        - rdkit.Dbase
        - rdkit.DistanceGeometry
        - rdkit.ForceField
        - rdkit.Geometry
        - rdkit.ML
        - rdkit.Numerics
        - rdkit.SimDivFilters
        - rdkit.VLib
        - rdkit.VLib.NodeLib
about:
    dev_url: https://github.com/rdkit/rdkit
    doc_url: http://www.rdkit.org/docs/index.html
    home: http://rdkit.org
    license: BSD 3-Clause
    license_file: license.txt
    summary: RDKit is a collection of cheminformatics and machine-learning software
        written in C++ and Python.
extra:
    copy_test_source_files: true
    final: true
    recipe-maintainers:
        - mcs07
        - pstjohn
