env_adt.yml

name: adt
channels:
  - conda-forge
  - insilichem
  - defaults
dependencies:
  - _libgcc_mutex=0.1=main
  - autodocktools-prepare=1.5.7=py27_0
  - blas=1.0=mkl
  - ca-certificates=2020.12.5=ha878542_0
  - cairo=1.16.0=h3fc0475_1005
  - certifi=2019.11.28=py27h8c360ce_1
  - fontconfig=2.13.1=h7e3eb15_1002
  - freetype=2.10.4=h7ca028e_0
  - glib=2.68.1=h36276a3_0
  - icu=67.1=he1b5a44_0
  - libffi=3.3=he6710b0_2
  - libgcc-ng=9.1.0=hdf63c60_0
  - libiconv=1.16=h516909a_0
  - libpng=1.6.37=h21135ba_2
  - libstdcxx-ng=9.1.0=hdf63c60_0
  - libuuid=2.32.1=h14c3975_1000
  - libxcb=1.13=h14c3975_1002
  - libxml2=2.9.10=h68273f3_2
  # - mkl=2017.0.3=0
  - ncurses=6.2=he6710b0_1
  # - numpy=1.13.1=py27_0
  - openbabel=3.0.0=py27hdef5451_1
  - pcre=8.44=he1b5a44_0
  - pip=9.0.1=py27_1
  - pixman=0.38.0=h516909a_1003
  - pthread-stubs=0.4=h36c2ea0_1001
  - python=2.7.18=h15b4118_1
  - python_abi=2.7=1_cp27mu
  - readline=8.1=h27cfd23_0
  # - setuptools=36.4.0=py27_1
  - sqlite=3.35.4=hdfb4753_0
  - tk=8.6.10=hbc83047_0
  - wheel=0.36.2=pyhd3eb1b0_0
  - xorg-kbproto=1.0.7=h14c3975_1002
  - xorg-libice=1.0.10=h516909a_0
  - xorg-libsm=1.2.3=h84519dc_1000
  - xorg-libx11=1.6.12=h516909a_0
  - xorg-libxau=1.0.9=h14c3975_0
  - xorg-libxdmcp=1.1.3=h516909a_0
  - xorg-libxext=1.3.4=h516909a_0
  - xorg-libxrender=0.9.10=h516909a_1002
  - xorg-renderproto=0.11.1=h14c3975_1002
  - xorg-xextproto=7.3.0=h14c3975_1002
  - xorg-xproto=7.0.31=h14c3975_1007
  - xz=5.2.5=h516909a_1
  - zlib=1.2.11=h7b6447c_3
  - pip:
      - setuptools==36.4.0
      - numpy==1.13.1
      - mkl==2017.0.3