Re: [Rdkit-discuss] Getting started with C++

2016-09-25 Thread Greg Landrum
I agree that it's a great idea, and i would certainly want to have the examples as part of the standard build/test suite. Having to manually check to docs would be a giant step backwards On Sat, Sep 24, 2016 at 6:12 PM +0200, "Brian Kelley" wrote: I think

Re: [Rdkit-discuss] Getting started with C++

2016-09-24 Thread Brian Kelley
I think this is a fantastic idea. I'll even contribute and include the examples in standard dist as cmake targets to boot. This will both help people start projects but also validate the docs. Nothing worse than examples that don't compile :) Brian Kelley > On Sep 24, 2016, at 11:51

[Rdkit-discuss] Getting started with C++

2016-09-24 Thread David Cosgrove
Hi All, I'm contemplating starting a chapter in the documentation called 'Getting Started with the RDKit in C++' which would mirror the information given in the Python chapter but with examples in C++ for those of us diehards who like to program in a compiled language. As I recall, the learning

Re: [Rdkit-discuss] getting started in C++

2016-05-09 Thread Rafal Roszak
On Mon, 9 May 2016 15:03:51 +0200 Greg Landrum wrote: > Though it would be nice to have better documentation for getting started > with the RDKit in C++, that would be even more time consuming than creating > the Python docs. It's unlikely to happen unless someone either

Re: [Rdkit-discuss] getting started in C++

2016-05-09 Thread Rocco Moretti
On Mon, May 9, 2016 at 6:20 AM, Rafal Roszak wrote: > > Is there any how-to, tutorial or other such documentation for RDKit in C++? > In my experience, a decent way to approach RDKit on the C++ level is to figure out how to do what you want on the Python level, and then

Re: [Rdkit-discuss] getting started in C++

2016-05-09 Thread Greg Landrum
Dear Rafal, On Mon, May 9, 2016 at 1:20 PM, Rafal Roszak wrote: > > Is there any how-to, tutorial or other such documentation for RDKit in C++? > For Python there is very nice > http://www.rdkit.org/docs/GettingStartedInPython.html intoduction. Is > there anything similar

[Rdkit-discuss] getting started in C++

2016-05-09 Thread Rafal Roszak
Hello, Is there any how-to, tutorial or other such documentation for RDKit in C++? For Python there is very nice http://www.rdkit.org/docs/GettingStartedInPython.html intoduction. Is there anything similar for C++ API? The only similar resource I found is Code/Demos/RDKit/ in source code which