[h5md-user] The impact of heterogeneous computing on workflows for biomolecular simulation and analysis

[Felix Höfling]

Some of you may find the article below interesting. It points at some  
challenges which we try to address with H5MD. It also gives support for  
preprocessing of the simulation data on-the-fly and storing only the  
results.

Cheatham, T. & Roe, D., The impact of heterogeneous computing on workflows  
for biomolecular simulation and analysis, Comput. Sci. Eng.  (2015), doi:  
10.1109/MCSE.2015.7
<http://ieeexplore.ieee.org/xpls/abs_all.jsp?arnumber=7006387>

Regards,

Felix