local_linux_python3.8.8.yml

name: openmm
channels:
  - conda-forge
  - defaults
dependencies:
  - _libgcc_mutex=0.1=main
  - _openmp_mutex=5.1=1_gnu
  - blas=1.0=mkl
  - ca-certificates=2023.7.22=hbcca054_0
  - cudatoolkit=10.2.89=hfd86e86_1
  - intel-openmp=2021.4.0=h06a4308_3561
  - ld_impl_linux-64=2.38=h1181459_1
  - libffi=3.3=he6710b0_2
  - libgcc-ng=11.2.0=h1234567_1
  - libgomp=11.2.0=h1234567_1
  - libstdcxx-ng=12.3.0=h0f45ef3_3
  - mkl=2021.4.0=h06a4308_640
  - mkl-service=2.4.0=py38h7f8727e_0
  - mkl_fft=1.3.1=py38hd3c417c_0
  - mkl_random=1.2.2=py38h51133e4_0
  - ncurses=6.4=h6a678d5_0
  - numpy=1.24.3=py38h14f4228_0
  - numpy-base=1.24.3=py38h31eccc5_0
  - ocl-icd=2.3.1=h7f98852_0
  - ocl-icd-system=1.0.0=1
  - openmm=8.0.0=py38h9522d40_1
  - openssl=1.1.1o=h166bdaf_0
  - pip=23.3=py38h06a4308_0
  - python=3.8.8=hdb3f193_5
  - python_abi=3.8=2_cp38
  - readline=8.2=h5eee18b_0
  - setuptools=68.0.0=py38h06a4308_0
  - six=1.16.0=pyhd3eb1b0_1
  - sqlite=3.41.2=h5eee18b_0
  - tk=8.6.12=h1ccaba5_0
  - wheel=0.41.2=py38h06a4308_0
  - xz=5.4.2=h5eee18b_0
  - zlib=1.2.13=h5eee18b_0
prefix: /home/qq/anaconda3/envs/openmm