I’m interesting about M.D simulation and Gaussian (Quantum Chemistry) calculation using CUDA.
But, there are two questions about using CUDA.
1. Graphic Card. (GTX 295 vs Quadro FX3800)
Which one could show better performance, approximately ? (In case, using CUDA processing)
And,…is there are anything special reasons for choose the Quadro ?
Simple specifications are below.
576 MHz, 1.8GB(DDR3), 896 bit 1988MHz
1GB (DDR3), 256 bit
2. Is there any restriction using GROMACS,GAUSSIAN03 with CUDA? (for example, no explicit water, only simple moelcule…etc)