conda.yml

name: mimosa
channels:
  - rdkit
  - soumith
  - defaults
dependencies:
  - _libgcc_mutex=0.1=main
  - blas=1.0=mkl
  - bzip2=1.0.8=h7b6447c_0
  - ca-certificates=2021.1.19=h06a4308_0
  - cairo=1.14.12=h8948797_3
  - certifi=2020.12.5=py37h06a4308_0
  - fontconfig=2.13.0=h9420a91_0
  - freetype=2.10.4=h5ab3b9f_0
  - glib=2.66.1=h92f7085_0
  - icu=58.2=he6710b0_3
  - intel-openmp=2020.2=254
  - jpeg=9b=h024ee3a_2
  - lcms2=2.11=h396b838_0
  - ld_impl_linux-64=2.33.1=h53a641e_7
  - libboost=1.73.0=h3ff78a5_11
  - libedit=3.1.20191231=h14c3975_1
  - libffi=3.3=he6710b0_2
  - libgcc-ng=9.1.0=hdf63c60_0
  - libpng=1.6.37=hbc83047_0
  - libstdcxx-ng=9.1.0=hdf63c60_0
  - libtiff=4.1.0=h2733197_1
  - libuuid=1.0.3=h1bed415_2
  - libxcb=1.14=h7b6447c_0
  - libxml2=2.9.10=hb55368b_3
  - lz4-c=1.9.3=h2531618_0
  - mkl=2020.2=256
  - mkl-service=2.3.0=py37he8ac12f_0
  - mkl_fft=1.2.0=py37h23d657b_0
  - mkl_random=1.1.1=py37h0573a6f_0
  - ncurses=6.2=he6710b0_1
  - numpy=1.19.2=py37h54aff64_0
  - numpy-base=1.19.2=py37hfa32c7d_0
  - olefile=0.46=py_0
  - openssl=1.1.1i=h27cfd23_0
  - pandas=1.2.1=py37ha9443f7_0
  - pcre=8.44=he6710b0_0
  - pillow=8.1.0=py37he98fc37_0
  - pip=20.3.3=py37h06a4308_0
  - pixman=0.40.0=h7b6447c_0
  - py-boost=1.73.0=py37ha9443f7_11
  - python=3.7.9=h7579374_0
  - python-dateutil=2.8.1=py_0
  - pytz=2020.5=pyhd3eb1b0_0
  - rdkit=2020.09.1.0=py37hd50e099_1
  - readline=8.0=h7b6447c_0
  - setuptools=52.0.0=py37h06a4308_0
  - six=1.15.0=pyhd3eb1b0_0
  - sqlite=3.33.0=h62c20be_0
  - tk=8.6.10=hbc83047_0
  - wheel=0.36.2=pyhd3eb1b0_0
  - xz=5.2.5=h7b6447c_0
  - zlib=1.2.11=h7b6447c_3
  - zstd=1.4.5=h9ceee32_0
  - pip:
    - chardet==4.0.0
    - cycler==0.10.0
    - decorator==4.4.2
    - fuzzywuzzy==0.18.0
    - idna==2.10
    - joblib==1.0.0
    - kiwisolver==1.3.1
    - matplotlib==3.3.4
    - networkx==2.5
    - pyparsing==2.4.7
    - pytdc==0.1.5
    - requests==2.25.1
    - scikit-learn==0.23.2
    - scipy==1.6.0
    - threadpoolctl==2.1.0
    - torch==1.7.1
    - torchvision==0.8.2
    - tqdm==4.56.0
    - typing-extensions==3.7.4.3
    - urllib3==1.26.3