[Rdkit-discuss] Conda install broken?
Open-Source Cheminformatics and Machine Learning
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From: Tim D. <tdu...@gm...> - 2019-03-20 17:36:04
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I create a new conda environment like this: > conda create -c rdkit -n my-rdkit rdkit I then activate the environment and try to use it and get an error related to the boost versions: > [timbo@xps pipelines-utils]$ conda activate my-rdkit > (my-rdkit) [timbo@xps pipelines-utils]$ python > Python 3.6.5 |Anaconda, Inc.| (default, Apr 29 2018, 16:14:56) > [GCC 7.2.0] on linux > Type "help", "copyright", "credits" or "license" for more information. > >>> from rdkit import Chem > Traceback (most recent call last): > File "<stdin>", line 1, in <module> > File "/home/timbo/github/rdkit/rdkit/rdkit/__init__.py", line 2, in > <module> > from .rdBase import rdkitVersion as __version__ > ImportError: libboost_python.so.1.64.0: cannot open shared object > file: No such file or directory If I do a 'conda list' I see that the version of py-boost that was installed was 1.67.0 > py-boost 1.67.0 py36h04863e7_4 What is wrong? Tim |