Re: [Rdkit-discuss] ctest

Hi Jim, ctest is a part of the cmake system that is used to build the rdkit: https://cmake.org/ there's great documentation available there. We use ctest after every build to run the RDKit test suite. The idea is to ensure that the code is working as expected. The tests are all run automatically a

[Rdkit-discuss] ctest

RDkit Experts, What is ctest? Is it fully documented somewhere? I am running PYTHON 3.5.2/RDkit 2017.03.1 on WINDOWS 7 via Pycharm 2017.2.3 Is it possible to run ctest in this environment? ctest seems to be a good way to exercise and test many of the capabilities of RDkit, s

Re: [Rdkit-discuss] RDKit installation in Virtual environment

This worked after setting the PYTHONPATH and installing pandas. so the blog is completely ready if someone wants to use. On 5 November 2017 at 12:49, Kiran Telukunta wrote: > Hi All, > > I was trying to install RDKit in the virtual environment with this > procedure >

[Rdkit-discuss] RDKit installation in Virtual environment

Hi All, I was trying to install RDKit in the virtual environment with this procedure . But then it is not working completely and getting following errors with ctest _ ctest Tes