New publication: Complete protein–protein association kinetics!

Author	Message
Stefan Project administrator Project developer Project tester Project scientist Send message Joined: 5 Mar 13 Posts: 348 Credit: 0 RAC: 0 Level Scientific publications	Message 47402 - Posted: 12 Jun 2017, 9:20:39 UTC Last modified: 12 Jun 2017, 9:59:33 UTC Hey all, some astute members might have noticed we got a new publication out? https://goo.gl/MoIi0d You remember these BARNA/BNBS workunits? Well, we finally made it :) Frank and Nuria did an incredible work with our simulations and got the paper published in Nature Chemistry which is a top-top journal in our field! To thank you all for this incredible contribution we will be handing out badges soon and you have my (and our group's) heartfelt thanks to all of you! ps. A layman news piece on the article https://www.upf.edu/home/-/asset_publisher/UI8Z8VAxU47P/content/id/8788860/maximized ID: 47402 · Rating: 0 · rate: / Reply Quote

[CSF] Thomas H.V. DUPONT Send message Joined: 20 Jul 14 Posts: 732 Credit: 130,089,082 RAC: 0 Level Scientific publications	Message 47403 - Posted: 12 Jun 2017, 9:27:30 UTC Congrats to all the GPUG Scientists! It's always nice to see that the processing of WU's takes the form of a scientific publication in a world-renowned journal, no matter how long it takes. Looking forward to seeing the badges awarded. Thanks for the heads-up Stefan! [CSF] Thomas H.V. Dupont Founder of the team CRUNCHERS SANS FRONTIERES 2.0 www.crunchersansfrontieres ID: 47403 · Rating: 0 · rate: / Reply Quote

Toni Volunteer moderator Project administrator Project developer Project tester Project scientist Send message Joined: 9 Dec 08 Posts: 1006 Credit: 5,068,599 RAC: 0 Level Scientific publications	Message 47405 - Posted: 12 Jun 2017, 9:56:08 UTC - in response to Message 47403. Last modified: 13 Jun 2017, 9:10:34 UTC I have not been involved in the study, so I think I can objectively stress how significant it is. In spirit, it's broadly analogous to the characterization of interactions between drugs (small molecules) and proteins we pioneered in 2011 - except that this time interactions of proteins with proteins are addressed. On the one hand, this is many orders of magnitude more difficult, given the sizes and flexibilities of the objects involved; but it is extremely significant, because while the discovery of small-molecule inhibitors is somewhat relenting, intervening on relatively larger interaction surfaces is seen as a promising way ahead. And, by the way, badges should have appeared by now :) So, congratulations to authors and cruchers! ID: 47405 · Rating: 0 · rate: / Reply Quote

[CSF] Thomas H.V. DUPONT Send message Joined: 20 Jul 14 Posts: 732 Credit: 130,089,082 RAC: 0 Level Scientific publications	Message 47406 - Posted: 12 Jun 2017, 9:59:16 UTC - in response to Message 47405. So, congratulations to authors and cruchers! +1 :) [CSF] Thomas H.V. Dupont Founder of the team CRUNCHERS SANS FRONTIERES 2.0 www.crunchersansfrontieres ID: 47406 · Rating: 0 · rate: / Reply Quote

PappaLitto Send message Joined: 21 Mar 16 Posts: 513 Credit: 4,673,458,277 RAC: 0 Level Scientific publications	Message 47408 - Posted: 12 Jun 2017, 11:13:35 UTC Congratulations everyone! ID: 47408 · Rating: 0 · rate: / Reply Quote

[CSF] Aleksey Belkov Send message Joined: 26 Dec 13 Posts: 86 Credit: 1,292,358,731 RAC: 0 Level Scientific publications	Message 47409 - Posted: 12 Jun 2017, 12:14:51 UTC - in response to Message 47402. Great job! ID: 47409 · Rating: 0 · rate: / Reply Quote

Michael H.W. Weber Send message Joined: 9 Feb 16 Posts: 78 Credit: 656,229,684 RAC: 0 Level Scientific publications	Message 47412 - Posted: 12 Jun 2017, 14:22:23 UTC - in response to Message 47403. Last modified: 12 Jun 2017, 14:23:04 UTC So, congratulations to authors and cruchers! +1 Michael. P.S.: Looking forward to seeing the badges awarded. Yes, they already have been awarded as you can see in my profile (this is actually the first and so far only GPUGRID publication I have contributed to). President of Rechenkraft.net - Germany's first and largest distributed computing organization. ID: 47412 · Rating: 0 · rate: / Reply Quote

[CSF] Thomas H.V. DUPONT Send message Joined: 20 Jul 14 Posts: 732 Credit: 130,089,082 RAC: 0 Level Scientific publications	Message 47414 - Posted: 12 Jun 2017, 18:21:59 UTC - in response to Message 47412. Yes, they already have been awarded as you can see in my profile (this is actually the first and so far only GPUGRID publication I have contributed to). GG Michael! :) [CSF] Thomas H.V. Dupont Founder of the team CRUNCHERS SANS FRONTIERES 2.0 www.crunchersansfrontieres ID: 47414 · Rating: 0 · rate: / Reply Quote

Matt Send message Joined: 11 Jan 13 Posts: 216 Credit: 846,538,252 RAC: 0 Level Scientific publications	Message 47418 - Posted: 13 Jun 2017, 5:08:39 UTC Last modified: 13 Jun 2017, 5:12:42 UTC VERY excited to have been in the top 1% of crunchers for this! I've already linked the paper on my social media accounts, but I was looking for an entry on this site's Science page and was unable to find it. I'm guessing it just hasn't been added yet. I'd like to send a link to that as well to my contacts so they can see what I (we) have been up to and can get excited to join in as well. P.S. My account RAC is low but that's only because I'm now crunching under the grcpool.com account. I have two full-time hosts (one w/ 1080Ti, the other w/ 1080) dedicated to GPUGrid. This project is still my top priority out of all BOINC projects. ID: 47418 · Rating: 0 · rate: / Reply Quote

Betting Slip Send message Joined: 5 Jan 09 Posts: 670 Credit: 2,498,095,550 RAC: 0 Level Scientific publications	Message 47425 - Posted: 13 Jun 2017, 10:14:27 UTC Well done. Excellent news. ID: 47425 · Rating: 0 · rate: / Reply Quote

[CSF] Thomas H.V. DUPONT Send message Joined: 20 Jul 14 Posts: 732 Credit: 130,089,082 RAC: 0 Level Scientific publications	Message 47426 - Posted: 13 Jun 2017, 10:37:51 UTC - in response to Message 47418. [...] but I was looking for an entry on this site's Science page and was unable to find it. I'm guessing it just hasn't been added yet [...] Same thing for the two previous publications which have still not been updated. - Multibody cofactor and substrate molecular recognition in the myo-inositol monophosphatase enzyme (neural disorders) - The pathway of ligand entry from the membrane bilayer to a lipid G protein-coupled receptor (cancer) [CSF] Thomas H.V. Dupont Founder of the team CRUNCHERS SANS FRONTIERES 2.0 www.crunchersansfrontieres ID: 47426 · Rating: 0 · rate: / Reply Quote

kain Send message Joined: 3 Sep 14 Posts: 152 Credit: 918,557,369 RAC: 19,063 Level Scientific publications	Message 47427 - Posted: 13 Jun 2017, 10:49:02 UTC Great news! Thank you for your hard work :) ID: 47427 · Rating: 0 · rate: / Reply Quote

[CSF] Thomas H.V. DUPONT Send message Joined: 20 Jul 14 Posts: 732 Credit: 130,089,082 RAC: 0 Level Scientific publications	Message 47498 - Posted: 25 Jun 2017, 17:28:39 UTC Stefan (or Gianni under ML) : is the full version of the publication available elsewhere (free)? Thanks so much for your reply :) [CSF] Thomas H.V. Dupont Founder of the team CRUNCHERS SANS FRONTIERES 2.0 www.crunchersansfrontieres ID: 47498 · Rating: 0 · rate: / Reply Quote

PappaLitto Send message Joined: 21 Mar 16 Posts: 513 Credit: 4,673,458,277 RAC: 0 Level Scientific publications	Message 47499 - Posted: 26 Jun 2017, 11:07:52 UTC - in response to Message 47498. Stefan (or Gianni under ML) : is the full version of the publication available elsewhere (free)? Thanks so much for your reply :) +1 ID: 47499 · Rating: 0 · rate: / Reply Quote

Trotador Send message Joined: 25 Mar 12 Posts: 103 Credit: 14,948,929,771 RAC: 11,649 Level Scientific publications	Message 47503 - Posted: 26 Jun 2017, 22:19:30 UTC Congratulations!, fantastic feeling seeing that our work becomes real science! ID: 47503 · Rating: 0 · rate: / Reply Quote