name: rmg_env
channels:
  - rdkit
  - pytorch
  - conda-forge
  - cantera
  - rmg
  - defaults
dependencies:
  - _libgcc_mutex=0.1=main
  - _tflow_select=2.3.0=mkl
  - absl-py=0.8.0=py37_0
  - algopy=0.5.7=py_0
  - astor=0.8.0=py37_0
  - attrs=19.2.0=py_0
  - backcall=0.1.0=py37_0
  - biopython=1.74=py37h7b6447c_0
  - blas=1.0=mkl
  - bleach=3.1.0=py37_0
  - bzip2=1.0.8=h7b6447c_0
  - c-ares=1.15.0=h7b6447c_1001
  - ca-certificates=2019.10.16=0
  - cairo=1.14.12=h8948797_3
  - cairocffi=0.9.0=py37_0
  - cantera=2.4.0=np115py37_2
  - cclib=1.6.1.rmg=py37h39e3cac_0
  - certifi=2019.9.11=py37_0
  - cffi=1.12.3=py37h2e261b9_0
  - chemprop=0.0.1=py_0
  - click=7.0=py37_0
  - coolprop=6.2.1=py37hf484d3e_0
  - coverage=4.5.4=py37h7b6447c_0
  - cycler=0.10.0=py37_0
  - cython=0.29.13=py37he6710b0_0
  - dbus=1.13.6=h746ee38_0
  - decorator=4.4.0=py37_1
  - defusedxml=0.6.0=py_0
  - descriptastorus=2.0.0=py_0
  - entrypoints=0.3=py37_0
  - expat=2.2.6=he6710b0_0
  - ffmpeg=4.0=hcdf2ecd_0
  - flask=1.1.1=py_0
  - fontconfig=2.13.0=h9420a91_0
  - freetype=2.9.1=h8a8886c_1
  - fribidi=1.0.5=h7b6447c_0
  - future=0.17.1=py37_0
  - gast=0.3.2=py_0
  - glib=2.56.2=hd408876_0
  - gmp=6.1.2=h6c8ec71_1
  - google-pasta=0.1.7=py_0
  - gprof2dot=2017.9.19=py_0
  - graphite2=1.3.13=h23475e2_0
  - graphviz=2.40.1=h21bd128_2
  - grpcio=1.16.1=py37hf8bcb03_1
  - gst-plugins-base=1.14.0=hbbd80ab_1
  - gstreamer=1.14.0=hb453b48_1
  - gunicorn=19.9.0=py37_0
  - h5py=2.9.0=py37h7918eee_0
  - harfbuzz=1.8.8=hffaf4a1_0
  - hdf5=1.10.4=hb1b8bf9_0
  - hyperopt=0.1.2=py_0
  - icu=58.2=h9c2bf20_1
  - intel-openmp=2019.4=243
  - ipykernel=5.1.2=py37h39e3cac_0
  - ipython=7.8.0=py37h39e3cac_0
  - ipython_genutils=0.2.0=py37_0
  - ipywidgets=7.5.1=py_0
  - itsdangerous=1.1.0=py37_0
  - jedi=0.15.1=py37_0
  - jinja2=2.10.3=py_0
  - joblib=0.13.2=py37_0
  - jpeg=9b=h024ee3a_2
  - jsonschema=3.0.2=py37_0
  - jupyter=1.0.0=py37_7
  - jupyter_client=5.3.4=py37_0
  - jupyter_console=6.0.0=py37_0
  - jupyter_core=4.6.0=py37_0
  - keras-applications=1.0.8=py_0
  - keras-preprocessing=1.1.0=py_1
  - kiwisolver=1.1.0=py37he6710b0_0
  - libboost=1.67.0=h46d08c1_4
  - libedit=3.1.20181209=hc058e9b_0
  - libffi=3.2.1=hd88cf55_4
  - libgcc-ng=9.1.0=hdf63c60_0
  - libgfortran-ng=7.3.0=hdf63c60_0
  - libopus=1.3=h7b6447c_0
  - libpng=1.6.37=hbc83047_0
  - libprotobuf=3.9.2=hd408876_0
  - libsodium=1.0.16=h1bed415_0
  - libstdcxx-ng=9.1.0=hdf63c60_0
  - libtiff=4.0.10=h2733197_2
  - libuuid=1.0.3=h1bed415_2
  - libvpx=1.7.0=h439df22_0
  - libxcb=1.13=h1bed415_1
  - libxml2=2.9.9=hea5a465_1
  - lpsolve=5.5.2.5=2
  - lpsolve55=5.5=py37h39e3cac_2
  - markdown=3.1.1=py37_0
  - markupsafe=1.1.1=py37h7b6447c_0
  - matplotlib=3.1.1=py37h5429711_0
  - memory_profiler=0.55.0=py37_0
  - mistune=0.8.4=py37h7b6447c_0
  - mkl=2019.4=243
  - mkl-service=2.3.0=py37he904b0f_0
  - mkl_fft=1.0.14=py37ha843d7b_0
  - mkl_random=1.1.0=py37hd6b4f25_0
  - mock=3.0.5=py37_0
  - mopac=2017=1
  - mpmath=1.1.0=py37_0
  - nbconvert=5.6.0=py37_1
  - nbformat=4.4.0=py37_0
  - ncurses=6.1=he6710b0_1
  - networkx=2.3=py_0
  - ninja=1.9.0=py37hfd86e86_0
  - nose=1.3.7=py37_2
  - notebook=6.0.1=py37_0
  - numdifftools=0.9.39=py_0
  - numpy=1.15.4=py37h7e9f1db_0
  - numpy-base=1.15.4=py37hde5b4d6_0
  - olefile=0.46=py37_0
  - openbabel=2.4.1=py37hf484d3e_7
  - openssl=1.1.1d=h7b6447c_3
  - pandas=0.25.1=py37he6710b0_0
  - pandoc=2.2.3.2=0
  - pandocfilters=1.4.2=py37_1
  - pango=1.42.4=h049681c_0
  - parso=0.5.1=py_0
  - patsy=0.5.1=py37_0
  - pcre=8.43=he6710b0_0
  - pexpect=4.7.0=py37_0
  - pickleshare=0.7.5=py37_0
  - pillow=6.2.0=py37h34e0f95_0
  - pip=19.2.3=py37_0
  - pixman=0.38.0=h7b6447c_0
  - prometheus_client=0.7.1=py_0
  - prompt_toolkit=2.0.10=py_0
  - protobuf=3.9.2=py37he6710b0_0
  - psutil=5.6.3=py37h7b6447c_0
  - ptyprocess=0.6.0=py37_0
  - py-boost=1.67.0=py37h04863e7_4
  - pycparser=2.19=py37_0
  - pydas=1.0.2=py37h1c1f16f_4
  - pydot=1.4.1=py37_0
  - pydqed=1.0.1=py37h1c1f16f_3
  - pygments=2.4.2=py_0
  - pymongo=3.9.0=py37he6710b0_0
  - pyparsing=2.4.2=py_0
  - pyqt=5.9.2=py37h05f1152_2
  - pyrdl=1.1.2=py37h14c3975_0
  - pyrsistent=0.15.4=py37h7b6447c_0
  - python=3.7.4=h265db76_1
  - python-dateutil=2.8.0=py37_0
  - pytorch-cpu=1.1.0=py3.7_cpu_0
  - pytz=2019.3=py_0
  - pyyaml=5.1.2=py37h7b6447c_0
  - pyzmq=18.1.0=py37he6710b0_0
  - qt=5.9.7=h5867ecd_1
  - qtconsole=4.5.5=py_0
  - quantities=0.12.3=pyh24bf2e0_0
  - rdkit=2019.03.4.0=py37hc20afe1_1
  - readline=7.0=h7b6447c_5
  - scikit-learn=0.21.3=py37hd81dba3_0
  - scipy=1.3.1=py37h7c811a0_0
  - send2trash=1.5.0=py37_0
  - setuptools=41.4.0=py37_0
  - sip=4.19.8=py37hf484d3e_0
  - six=1.12.0=py37_0
  - sqlite=3.30.0=h7b6447c_0
  - statsmodels=0.10.1=py37hdd07704_0
  - symmetry=1.0.1=0
  - tensorboard=1.14.0=py37hf484d3e_0
  - tensorboardx=1.9=py_0
  - tensorflow=1.14.0=mkl_py37h45c423b_0
  - tensorflow-base=1.14.0=mkl_py37h7ce6ba3_0
  - tensorflow-estimator=1.14.0=py_0
  - termcolor=1.1.0=py37_1
  - terminado=0.8.2=py37_0
  - testpath=0.4.2=py37_0
  - tk=8.6.8=hbc83047_0
  - torchvision-cpu=0.3.0=py37_cuNone_1
  - tornado=6.0.3=py37h7b6447c_0
  - tqdm=4.36.1=py_0
  - traitlets=4.3.3=py37_0
  - wcwidth=0.1.7=py37_0
  - webencodings=0.5.1=py37_1
  - werkzeug=0.16.0=py_0
  - wheel=0.33.6=py37_0
  - widgetsnbextension=3.5.1=py37_0
  - wrapt=1.11.2=py37h7b6447c_0
  - xlwt=1.3.0=py37_0
  - xz=5.2.4=h14c3975_4
  - yaml=0.1.7=had09818_2
  - zeromq=4.3.1=he6710b0_3
  - zlib=1.2.11=h7b6447c_3
  - zstd=1.3.7=h0b5b093_0
  - pip:
    - colorama==0.4.3
    - filelock==3.0.12
    - funcsigs==1.0.2
    - importlib-metadata==1.2.0
    - more-itertools==8.0.2
    - packaging==19.2
    - pluggy==0.13.1
    - py==1.8.0
    - pytest==5.3.1
    - ray==0.7.6
    - redis==3.3.11
    - zipp==0.6.0