Dear HOOMD users,
I have installed HOOMD with anaconda. After installing hoomd using "conda install -c conda-forge hoomd=*=*gpu* -y", I get error like
"Traceback (most recent call last):
File "test.py", line 11, in <module>
File "/home/yklee/anaconda3/lib/python3.8/site-packages/hoomd/__init__.py", line 201, in run context.current.system.run(int(tsteps), callback_period, callback, limit_hours, int(limit_multiple));
RuntimeError: scan failed on 2nd step: cudaErrorInvalidValue: invalid argument"
It seems like my system doesn't recognize cuda package. But I am using gromacs with gpu package so that I don't get what the problem is. Can anyone give me a hand?
With my regards