GPUGrid: WARNING/CHALLENGE: VERY LONG WU (VERYLONG_CXCL12_confAna)

[RSS]

[quote]If it was possible to select the WU's, I would take some of the VERY LONG. Or ... is there a way to download them ? Or will you send them with "high priority" ? NB Will receive my 4th GTX970 tomorrow :D Purchased only "because" of GPUGRID ;. . .

More... (http://www.gpugrid.net/forum_thread.php?id=3988)

[zombie67]

400k credit bonus for these. Get em while you can!

[Sarge104]

Please READ!!!!!! (http://www.gpugrid.net/forum_thread.php?id=3988&nowrap=true#39636)

Hopefully you all get this information in time, or a lot of good work will be lost. Upload limit on these tasks is incorrect and must be modified to allow the task to not fail on upload.

[Sarge104]

http://www.gpugrid.net/forum_thread.php?id=3988&nowrap=true#39722

Info on what those particular WU's where for.


If someone is interested in this particular experiment: we are trying to assess the conformational behavior of a chemokine named CXCL12, related to a vast number of diseases including different types of cancer, neurodegenerative diseases and autoinmune disorders. By analysing the conformational changes occurring in a scale of 200ns (the length of the simulations you just crunched) we are aiming to unravel new surfaces and druggable protein pockets that we can use to design drugs against. Molecular simulations are, perhaps at exception of some NMR techniques, the only way of atomically determining the protein conformational space at such small scales and thus provide a unique insight into the natural dynamics of proteins.