Md Lokman Hossen
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Md Lokman Hossen
Hi, I am using auto_martini dev branch and after hitting following command: "python -m auto_martini --smi "N1=C(N)NN=C1N" --mol GUA --top GUA.itp"" I got following error: "/usr/local/lib/python3.9/site-packages/auto_martini-0.0.2-py3.9-macosx-10.14-x86_64.egg/auto_martini/solver.py:112: VisibleDeprecationWarning: Creating an ndarray...