GPU4N （85.9）

# conda environments:
#
base                  *  /home/chpeng/anaconda3
AI-NCI                   /home/chpeng/anaconda3/envs/AI-NCI 可删除
DeepPurpose              /home/chpeng/anaconda3/envs/DeepPurpose 田亚鑫
DeepPurpose_1            /home/chpeng/anaconda3/envs/DeepPurpose_1
EquiScore                /home/chpeng/anaconda3/envs/EquiScore 周兆寅
FLAN-T5                  /home/chpeng/anaconda3/envs/FLAN-T5
GBDT                     /home/chpeng/anaconda3/envs/GBDT
MDtraj                   /home/chpeng/anaconda3/envs/MDtraj 吴乐云
MINN                     /home/chpeng/anaconda3/envs/MINN
Masif                    /home/chpeng/anaconda3/envs/Masif 可删除
PyAutoFEP                /home/chpeng/anaconda3/envs/PyAutoFEP 吴乐云
SuperAtomicCharge        /home/chpeng/anaconda3/envs/SuperAtomicCharge 李锦添
TCbaseline               /home/chpeng/anaconda3/envs/TCbaseline
af2-cuda11.3             /home/chpeng/anaconda3/envs/af2-cuda11.3 组里AF2运行环境
alchemical_analysis      /home/chpeng/anaconda3/envs/alchemical_analysis
alchemlyb                /home/chpeng/anaconda3/envs/alchemlyb
biogpt                   /home/chpeng/anaconda3/envs/biogpt 田亚鑫
blm                      /home/chpeng/anaconda3/envs/blm
cgschnet                 /home/chpeng/anaconda3/envs/cgschnet
cmapPy                   /home/chpeng/anaconda3/envs/cmapPy 廖清怡
dssp                     /home/chpeng/anaconda3/envs/dssp
fpocket                  /home/chpeng/anaconda3/envs/fpocket 软件
gcc_12                  /home/chpeng/anaconda3/envs/gcc_12 暂时保留
gcc_8_5                 /home/chpeng/anaconda3/envs/gcc_8_5 暂时保留
gimlet                   /home/chpeng/anaconda3/envs/gimlet
glycam                   /home/chpeng/anaconda3/envs/glycam 吴乐云
ljt                      /home/chpeng/anaconda3/envs/ljt 李锦添
lqy                      /home/chpeng/anaconda3/envs/lqy 廖清怡
lywu                     /home/chpeng/anaconda3/envs/lywu 吴乐云
mdanalysis               /home/chpeng/anaconda3/envs/mdanalysis 吴乐云
molopt                   /home/chpeng/anaconda3/envs/molopt
my_cmapPy_env            /home/chpeng/anaconda3/envs/my_cmapPy_env
pdb2pqr                  /home/chpeng/anaconda3/envs/pdb2pqr 吴乐云
prolif                   /home/chpeng/anaconda3/envs/prolif
prolif_2.0               /home/chpeng/anaconda3/envs/prolif_2.0
propka3                  /home/chpeng/anaconda3/envs/propka3 吴乐云
pure                     /home/chpeng/anaconda3/envs/pure
py2.7                    /home/chpeng/anaconda3/envs/py2.7
py3-7                    /home/chpeng/anaconda3/envs/py3-7
py3.7                    /home/chpeng/anaconda3/envs/py3.7
pymol2.5                 /home/chpeng/anaconda3/envs/pymol2.5
pyrosetta                /home/chpeng/anaconda3/envs/pyrosetta 可删除
pytorch_1.8.1            /home/chpeng/anaconda3/envs/pytorch_1.8.1
pytorch_gpu         /home/chpeng/anaconda3/envs/pytorch_gpu D3AICov运行环境
pytorch_gpu_10.2         /home/chpeng/anaconda3/envs/pytorch_gpu_10.2
pytorch_gpu_8.0          /home/chpeng/anaconda3/envs/pytorch_gpu_8.0
pytorch_gpu_9.1          /home/chpeng/anaconda3/envs/pytorch_gpu_9.1 廖清怡
pytorch_ttt              /home/chpeng/anaconda3/envs/pytorch_ttt
pzy                      /home/chpeng/anaconda3/envs/pzy彭紫玉
rdkit-env                /home/chpeng/anaconda3/envs/rdkit-env 保留
rdkit_faiss              /home/chpeng/anaconda3/envs/rdkit_faiss
tactics                  /home/chpeng/anaconda3/envs/tactics
tankbind_py38            /home/chpeng/anaconda3/envs/tankbind_py38
tensorflow_gpu           /home/chpeng/anaconda3/envs/tensorflow_gpu 廖清怡
tf2                      /home/chpeng/anaconda3/envs/tf2
tf26                     /home/chpeng/anaconda3/envs/tf26 廖清怡
torch1.6                 /home/chpeng/anaconda3/envs/torch1.6 廖清怡
torchdrug                /home/chpeng/anaconda3/envs/torchdrug
ttt                      /home/chpeng/anaconda3/envs/ttt
unimol-2                 /home/chpeng/anaconda3/envs/unimol-2 李锦添
ycshi                    /home/chpeng/anaconda3/envs/ycshi 石峪成