[docs] README.md: create installation guide
alyferryhalo opened this issue · comments
Just an idea for docs. It could be pretty helpful if there will be an installation guide in the README.md file.
Hi,
Have you installed mmpdb successfully? I can not find any installation guide from the README.md file, either
Hey.
If I remember well, I did this (on macOS Monterey 12.01):
conda create -c conda-forge -n mmpdb rdkit
conda activate mmpdb
conda install -c conda-forge apsw
cd Documents
mkdir mmpdb
cd mmpdb
git clone https://github.com/rdkit/mmpdb.git
cd mmpdb
python setup.py install
And then I checked:
mmpdb help-analysis
You should get a long help output, Hope this will work for you!
Hi,
These commands really work, I have installed this successfully. Thanks for your help!
Thanks for supplying this. I had an issue installing using conda. Even after creating a new environment there were package clashes from conda. The solution was to use mamba instead and everything seemed to work fine:
Also I should mention, you need to add
mamba create -c conda-forge -n mmpdb rdkit python=3.6
initially it just installed 3.11 for me and while the mmpdb --help command works the fragmentation procedure will die without 3.6