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03-26-14, 11:52 AM
A big hi to all the users! I'm currently undergoing my master thesis in the lab and I'll very proud to participate in this fantastic community for the first time by sending some simulations to gpugrid. You will identify them with the ID A2AR, which stands for A2A adenosine receptor. It is a membrane protein from to a huge family called GPCRs that is key on neurodegenerative diseases such as Parkinson and therefore an important target of drug development. With these simulations we will try to prove the affinity of a couple of known ligands in silico.
More... (http://www.gpugrid.net/forum_thread.php?id=3689)
More... (http://www.gpugrid.net/forum_thread.php?id=3689)