RDKit is a popular open-source library for chemoinformatics and machine learning applied to chemoinformatics.
I am trying to install Rdkit on ubuntu and I have problem with the conda configuration. I have reinstalled anaconda3 …
python conda rdkitI'm using RDKit to calculate molecular similarity based on Tanimoto coefficient between two lists of molecules with SMILE structures. Now …
python csv similarity fingerprint rdkitI am trying to get rdkit working on my Windows 7 system with Anaconda and Python 2.7. I have been following the …
python anaconda rdkit