name: reinvent
channels:
  - rdkit
  - pytorch
  - OpenEye/label/dev
  - conda-forge
  - numba
  - defaults
dependencies:
  - appnope=0.1.0=py36hf537a9a_0
  - attrs=19.3.0=py_0
  - backcall=0.1.0=py36_0
  - blas=1.0=mkl
  - bleach=3.1.4=py_0
  - bzip2=1.0.8=h1de35cc_0
  - ca-certificates=2020.1.1=0
  - cairo=1.14.12=hc4e6be7_4
  - certifi=2020.6.20=py36_0
  - cffi=1.14.0=py36hb5b8e2f_0
  - chardet=3.0.4=py36_1003
  - cryptography=2.9.2=py36ha12b0ac_0
  - cycler=0.10.0=py36hfc81398_0
  - decorator=4.4.2=py_0
  - defusedxml=0.6.0=py_0
  - entrypoints=0.3=py36_0
  - expat=2.2.6=h0a44026_0
  - fontconfig=2.13.0=h5d5b041_1
  - freetype=2.9.1=hb4e5f40_0
  - gettext=0.19.8.1=h15daf44_3
  - git=2.23.0=pl526h6951d83_0
  - gitdb2=2.0.6=py_0
  - gitpython=2.1.13=py_0
  - glib=2.63.1=hd977a24_0
  - icc_rt=2018.0.2=0
  - icu=58.2=h0a44026_3
  - idna=2.9=py_1
  - imbalanced-learn=0.7.0=py_1
  - importlib_metadata=1.5.0=py36_0
  - intel-openmp=2019.4=233
  - ipykernel=5.1.4=py36h39e3cac_0
  - ipython=7.13.0=py36h5ca1d4c_0
  - ipython_genutils=0.2.0=py36_0
  - ipywidgets=7.5.1=py_0
  - jedi=0.17.0=py36_0
  - jinja2=2.11.2=py_0
  - joblib=0.14.1=py_0
  - jpeg=9b=he5867d9_2
  - json5=0.9.4=py_0
  - jsonschema=3.2.0=py36_0
  - jupyter_client=6.1.3=py_0
  - jupyter_core=4.6.3=py36_0
  - jupyterlab=1.2.6=pyhf63ae98_0
  - jupyterlab_server=1.1.1=py_0
  - kiwisolver=1.2.0=py36h04f5b5a_0
  - krb5=1.17.1=hddcf347_0
  - libblas=3.8.0=7_hd44dcd8_netlib
  - libboost=1.67.0=hebc422b_4
  - libcblas=3.8.0=7_hd44dcd8_netlib
  - libcurl=7.69.1=h051b688_0
  - libcxx=10.0.0=1
  - libedit=3.1.20181209=hb402a30_0
  - libffi=3.2.1=h0a44026_6
  - libgfortran=3.0.1=h93005f0_2
  - libiconv=1.16=h1de35cc_0
  - libpng=1.6.37=ha441bb4_0
  - libsodium=1.0.16=h3efe00b_0
  - libssh2=1.9.0=ha12b0ac_1
  - libtiff=4.1.0=hcb84e12_0
  - libxml2=2.9.9=hf6e021a_1
  - llvm-openmp=10.0.0=h28b9765_0
  - llvmlite=0.33.0rc1=py36_0
  - markupsafe=1.1.1=py36h1de35cc_0
  - matplotlib=3.1.3=py36_0
  - matplotlib-base=3.1.3=py36h9aa3819_0
  - mistune=0.8.4=py36h1de35cc_0
  - mkl=2018.0.3=1
  - mkl_fft=1.0.6=py36hb8a8100_0
  - mkl_random=1.0.1=py36h5d10147_1
  - more-itertools=8.2.0=py_0
  - nbconvert=5.6.1=py36_0
  - nbformat=5.0.6=py_0
  - ncurses=6.2=h0a44026_1
  - ninja=1.9.0=py36h04f5b5a_0
  - notebook=6.0.3=py36_0
  - numba=0.50.0rc1=np1.11py3.6h6440ff4_gff3af47_2
  - numpy=1.15.4=py36h6a91979_0
  - numpy-base=1.15.4=py36h8a80b8c_0
  - olefile=0.46=py36_0
  - openeye-toolkits=2017.10.1=py36_0
  - openssl=1.1.1g=h1de35cc_0
  - packaging=20.3=py_0
  - pandas=1.0.3=py36h6c726b0_0
  - pandoc=2.2.3.2=0
  - pandocfilters=1.4.2=py36_1
  - parso=0.7.0=py_0
  - pcre=8.43=h0a44026_0
  - perl=5.26.2=h4e221da_0
  - pexpect=4.8.0=py36_0
  - pickleshare=0.7.5=py36_0
  - pillow=7.1.2=py36h4655f20_0
  - pip=20.0.2=py36_3
  - pixman=0.38.0=h1de35cc_0
  - pluggy=0.13.1=py36_0
  - prometheus_client=0.7.1=py_0
  - prompt-toolkit=3.0.4=py_0
  - prompt_toolkit=3.0.4=0
  - ptyprocess=0.6.0=py36_0
  - py=1.8.1=py_0
  - py-boost=1.67.0=py36h6440ff4_4
  - pycparser=2.20=py_0
  - pygments=2.6.1=py_0
  - pyopenssl=19.1.0=py36_0
  - pyparsing=2.4.7=py_0
  - pyrsistent=0.16.0=py36h1de35cc_0
  - pysocks=1.7.1=py36_0
  - pytest=5.4.2=py36_0
  - python=3.6.10=h359304d_0
  - python-dateutil=2.8.1=py_0
  - python_abi=3.6=1_cp36m
  - pytorch=0.4.0=py36_cuda0.0_cudnn0.0_1
  - pytz=2020.1=py_0
  - pyzmq=18.1.1=py36h0a44026_0
  - rdkit=2020.03.2.0=py36h65625ec_1
  - readline=7.0=h1de35cc_5
  - requests=2.23.0=py36_0
  - scikit-learn=0.23.1=py36hef903b7_0
  - scipy=1.1.0=py36h28f7352_1
  - seaborn=0.10.1=py_0
  - send2trash=1.5.0=py36_0
  - setuptools=46.2.0=py36_0
  - six=1.14.0=py36_0
  - smmap2=2.0.5=py36_0
  - sqlite=3.31.1=h5c1f38d_1
  - tbb=2020.0=h04f5b5a_0
  - tbb4py=2020.0=py36h04f5b5a_0
  - terminado=0.8.3=py36_0
  - testpath=0.4.4=py_0
  - threadpoolctl=2.1.0=pyh5ca1d4c_0
  - tk=8.6.8=ha441bb4_0
  - tornado=6.0.4=py36h1de35cc_1
  - traitlets=4.3.3=py36_0
  - urllib3=1.25.8=py36_0
  - wcwidth=0.1.9=py_0
  - webencodings=0.5.1=py36_1
  - wheel=0.34.2=py36_0
  - widgetsnbextension=3.5.1=py36_0
  - xz=5.2.5=h1de35cc_0
  - zeromq=4.3.1=h0a44026_3
  - zipp=3.1.0=py_0
  - zlib=1.2.11=h1de35cc_3
  - zstd=1.3.7=h5bba6e5_0
  - pip:
    - bokeh==2.0.2
    - click==7.1.2
    - cloudpickle==1.4.1
    - contextvars==2.4
    - dill==0.3.1.1
    - distributed==2.16.0
    - fsspec==0.7.3
    - heapdict==1.0.1
    - immutables==0.14
    - locket==0.2.0
    - msgpack==1.0.0
    - pandarallel==1.4.8
    - partd==1.1.0
    - psutil==5.7.0
    - pyyaml==5.3.1
    - sortedcontainers==2.1.0
    - tblib==1.6.0
    - toolz==0.10.0
    - tqdm==4.46.0
    - typing-extensions==3.7.4.2
    - zict==2.0.0
prefix: /usr/local/Caskroom/miniconda/base/envs/reinvent