Re: [Open Babel] OpenBabel+OpenACC/OpenMp

2016-03-26 Thread Pranav
I am sorry if the question was very general. The thing is that the problem I am facing is too complex to explain in a post. that is why I wanted to know if someone has experience in these three categories so that I can explain the problem by personal discussion. But I do realise that posting this

Re: [Open Babel] OpenBabel+OpenACC/OpenMp

2016-02-02 Thread Geoffrey Hutchison
> I wanted to ask if anyone has any experience with GPU programming using C++. > I wanted to know about general procedure/ approach . because all the codes > that i am compiling on GPU are failing. This really is not the correct forum for this. If you’re interested in compiling Open Babel with

Re: [Open Babel] OpenBabel+OpenACC/OpenMp

2016-02-02 Thread Craig James
This is a very general question that might best be asked on a C++ forum or a forum devoted to GPU programming. My understanding is that you can't just compile regular C++ code for a GPU. It has to be written very specifically for the GPU with an understanding of how the GPU works. Craig On Tue,

[Open Babel] OpenBabel+OpenACC/OpenMp

2016-02-02 Thread Pranav Khade
Hello, I wanted to ask if anyone has any experience with GPU programming using C++. I wanted to know about general procedure/ approach . because all the codes that i am compiling on GPU are failing. Looking forward for the help. Thanks, Pranav