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protac-rl-env.yml
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protac-rl-env.yml
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name: PROTAC-RL
channels:
- rdkit
- pytorch
- anaconda
- defaults
dependencies:
- _libgcc_mutex=0.1=main
- _openmp_mutex=5.1=1_gnu
- blas=1.0=mkl
- brotlipy=0.7.0=py36h27cfd23_1003
- bzip2=1.0.8=h7b6447c_0
- ca-certificates=2022.07.19=h06a4308_0
- cairo=1.16.0=h19f5f5c_2
- certifi=2021.5.30=py36h06a4308_0
- cffi=1.14.6=py36h400218f_0
- charset-normalizer=2.0.4=pyhd3eb1b0_0
- cryptography=35.0.0=py36hd23ed53_0
- cudatoolkit=10.2.89=hfd86e86_1
- dataclasses=0.8=pyh4f3eec9_6
- ffmpeg=4.3=hf484d3e_0
- fontconfig=2.13.1=h6c09931_0
- freetype=2.11.0=h70c0345_0
- glib=2.69.1=h4ff587b_1
- gmp=6.2.1=h295c915_3
- gnutls=3.6.15=he1e5248_0
- icu=58.2=he6710b0_3
- idna=3.3=pyhd3eb1b0_0
- intel-openmp=2022.1.0=h9e868ea_3769
- joblib=0.13.2=py36_0
- jpeg=9e=h7f8727e_0
- lame=3.100=h7b6447c_0
- lcms2=2.12=h3be6417_0
- ld_impl_linux-64=2.38=h1181459_1
- lerc=3.0=h295c915_0
- libboost=1.67.0=h46d08c1_4
- libdeflate=1.8=h7f8727e_5
- libffi=3.3=he6710b0_2
- libgcc-ng=11.2.0=h1234567_1
- libgfortran-ng=11.2.0=h00389a5_1
- libgfortran5=11.2.0=h1234567_1
- libgomp=11.2.0=h1234567_1
- libiconv=1.16=h7f8727e_2
- libidn2=2.3.2=h7f8727e_0
- libpng=1.6.37=hbc83047_0
- libstdcxx-ng=11.2.0=h1234567_1
- libtasn1=4.16.0=h27cfd23_0
- libtiff=4.4.0=hecacb30_0
- libunistring=0.9.10=h27cfd23_0
- libuuid=1.0.3=h7f8727e_2
- libuv=1.40.0=h7b6447c_0
- libwebp-base=1.2.4=h5eee18b_0
- libxcb=1.15=h7f8727e_0
- libxml2=2.9.14=h74e7548_0
- lz4-c=1.9.3=h295c915_1
- mkl=2020.2=256
- mkl-service=2.3.0=py36he8ac12f_0
- mkl_fft=1.3.0=py36h54f3939_0
- mkl_random=1.1.1=py36h0573a6f_0
- ncurses=6.3=h5eee18b_3
- nettle=3.7.3=hbbd107a_1
- ninja=1.10.2=h06a4308_5
- ninja-base=1.10.2=hd09550d_5
- numpy=1.19.2=py36h54aff64_0
- numpy-base=1.19.2=py36hfa32c7d_0
- olefile=0.46=py36_0
- openh264=2.1.1=h4ff587b_0
- openjpeg=2.4.0=h3ad879b_0
- openssl=1.1.1q=h7f8727e_0
- pandas=1.1.5=py36ha9443f7_0
- pcre=8.45=h295c915_0
- pillow=8.3.1=py36h2c7a002_0
- pip=21.2.2=py36h06a4308_0
- pixman=0.40.0=h7f8727e_1
- py-boost=1.67.0=py36h04863e7_4
- pycparser=2.21=pyhd3eb1b0_0
- pyopenssl=22.0.0=pyhd3eb1b0_0
- pysocks=1.7.1=py36h06a4308_0
- python=3.6.10=h7579374_2
- python-dateutil=2.8.2=pyhd3eb1b0_0
- pytorch=1.7.0=py3.6_cuda10.2.89_cudnn7.6.5_0
- pytorch-mutex=1.0=cuda
- pytz=2021.3=pyhd3eb1b0_0
- rdkit=2020.03.3.0=py36hc20afe1_1
- readline=8.1.2=h7f8727e_1
- requests=2.27.1=pyhd3eb1b0_0
- scikit-learn=0.24.2=py36ha9443f7_0
- setuptools=58.0.4=py36h06a4308_0
- six=1.16.0=pyhd3eb1b0_1
- sqlite=3.39.3=h5082296_0
- threadpoolctl=2.2.0=pyh0d69192_0
- tk=8.6.12=h1ccaba5_0
- torchaudio=0.7.0=py36
- torchvision=0.8.1=py36_cu102
- tqdm=4.62.3=pyhd3eb1b0_1
- typing_extensions=4.1.1=pyh06a4308_0
- urllib3=1.26.8=pyhd3eb1b0_0
- wheel=0.37.1=pyhd3eb1b0_0
- xz=5.2.6=h5eee18b_0
- zlib=1.2.12=h5eee18b_3
- zstd=1.5.2=ha4553b6_0
- pip:
- pexpect==4.8.0
- ptyprocess==0.7.0
- scipy==1.1.0
- torchtext==0.4.0
prefix: /storage/prageeth_wijewardhane/anaconda3/envs/PROTAC-RL