I installed the environment through environment.yml, and after successful installation, I ran Drug Properties Prediction with an error message as follows:
Traceback (most recent call last):
File "/mnt/sdb1/yinxiaoru/AIDD/project/ADMET/project/DeepPurpose-master/DeepPurpose/utils.py", line 15, in
from descriptastorus.descriptors import rdDescriptors, rdNormalizedDescriptors
ModuleNotFoundError: No module named 'descriptastorus'
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "run_admet.py", line 4, in
from DeepPurpose import CompoundPred as models
File "/mnt/sdb1/yinxiaoru/AIDD/project/ADMET/project/DeepPurpose-master/DeepPurpose/CompoundPred.py", line 24, in
from DeepPurpose.utils import
File "/mnt/sdb1/yinxiaoru/AIDD/project/ADMET/project/DeepPurpose-master/DeepPurpose/utils.py", line 17, in
raise ImportError("Please install pip install git+https://github.com/bp-kelley/descriptastorus and pip install pandas-flavor")
ImportError: Please install pip install git+https://github.com/bp-kelley/descriptastorus and pip install pandas-flavor
Prompt for installing descriptastrorus and pandas flavor. An error occurred while installing descriptastrorus, with the following error message:
× git clone --filter=blob:none --quiet https://github.com/bp-kelley/descriptastorus /mnt/sdb1/yinxiaoru/.temp_dir/pip-req-build-q1ez9ilq did not run successfully.
│ exit code: 128
╰─> See above for output.
note: This error originates from a subprocess, and is likely not a problem with pip.
error: subprocess-exited-with-error
× git clone --filter=blob:none --quiet https://github.com/bp-kelley/descriptastorus /mnt/sdb1/yinxiaoru/.temp_dir/pip-req-build-q1ez9ilq did not run successfully.
│ exit code: 128
╰─> See above for output.
note: This error originates from a subprocess, and is likely not a problem with pip.
I installed the environment through environment.yml, and after successful installation, I ran Drug Properties Prediction with an error message as follows:
Prompt for installing descriptastrorus and pandas flavor. An error occurred while installing descriptastrorus, with the following error message:
pip install git+https://github.com/bp-kelley/descriptastorus