Update Charmm
Message boards : Application Info : Update Charmm
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I'm wondering why you are still using Charmm version c34a2, a developmental release from 2007. The latest developmental release is 37a1 and has not only performance enhancements, but OpenMM support (including GPU support). The latest stable release is from september 2011, c36b1, which also has performance enhancements and GPU support. BTW, I'm a bit confused when you say Charmm version 7, as it doesn't correspond to any known version numbering systems from http://www.charmm.org . Is there any reason that you are staying on a developmental release from 2007? |
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ID:
7032 | Rating: 0
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I suppose it's because they don't give a shoop da whoop about their project for at least this long. And are horribly understaffed, as I understand. |
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7033 | Rating: 0
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At least one of the admin responds in topics, but I agree with MaW overall. Understaffed and little attention from those who run it.
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ID:
7034 | Rating: 0
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I'm wondering why you are still using Charmm version c34a2, a developmental release from 2007. The latest developmental release is 37a1 and has not only performance enhancements, but OpenMM support (including GPU support). The latest stable release is from september 2011, c36b1, which also has performance enhancements and GPU support. I cannot understand. On charmm site seems that c37b1 is latest stable... So, Docking code is very old!! |
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ID:
7036 | Rating: 0
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You're right - latest stable version is c37b1.
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ID:
7037 | Rating: 0
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Still, it shouldn't be running on 5 year old software when there is a new release every couple of months. New releases with a LOT of improvements!! |
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ID:
7038 | Rating: 0
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well, we can hope and pray that someone, somewhere, donates the time and/or money to update Docking.
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ID:
7040 | Rating: 0
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It would be nice to have more regular updates and update their software. |
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ID:
7043 | Rating: 0
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well, we can hope and pray that someone, somewhere, donates the time and/or money to update Docking. Can thay release the source code of framework, like Poem?? Community can help... |
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ID:
7046 | Rating: 0
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well, we can hope and pray that someone, somewhere, donates the time and/or money to update Docking. I think CHARMM is a commercial software... |
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ID:
7048 | Rating: 0
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Can thay release the source code of framework, like Poem?? You're right. In the CHARMM site: "Academic users can obtain CHARMM by contacting The CHARMM Development Project. For-profit companies should contact Accelrys Inc.We distribute the source code of the CHARMM program with documentation to individual academic research groups for a $600 licensing fee" So, no upgrade until the team decide to do it... |
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ID:
7053 | Rating: 0
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Can thay release the source code of framework, like Poem?? I have to believe that the commercial Charmm software has free upgrades, at least for academic users. An upgrade price is a good reason not to upgrade, but if its a free upgrade, then I feel its just their laziness/unwilling to put the time/effort into it. |
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ID:
7057 | Rating: 0
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I'm wondering why you are still using Charmm version c34a2, a developmental release from 2007. The latest developmental release is 37a1 and has not only performance enhancements, but OpenMM support (including GPU support). New OpenMM is out (version 5) Hope this version will be implemented in Charmm (and in Docking!!!) |
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ID:
7068 | Rating: 0
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Very interesting documentation
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ID:
7096 | Rating: 0
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David Ball
Forum moderator Volunteer tester 
Joined: Sep 18 06 Posts: 274 ID: 115 Credit: 1,634,401 RAC: 0 |
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When docking first started, there was a very good programmer who got charmm working under boinc. Once he got it working, he went to work for SGI and I don't think they have had anyone who does that type of programming attached to the project since then. Just people who can change the website. It's a shame he's not there anymore.
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ID:
7101 | Rating: 0
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Docking@Home support OpenMM ?
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ID:
7102 | Rating: 0
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When docking first started, there was a very good programmer who got charmm working under boinc. Once he got it working, he went to work for SGI and I don't think they have had anyone who does that type of programming attached to the project since then. It's so difficult for University of Delaware to find out a developer? A colleague of Michaela at University, a student, a PHD... http://www.udel.edu/udaily/2013/apr/scholars-posters-042313.html |
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ID:
7104 | Rating: 0
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Docking@Home support OpenMM ? Docking uses CHARMM CHARMM supports OPENMM So, Docking supports OPENMM The problem is that Docking uses an old version |
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ID:
7105 | Rating: 0
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News about updating? |
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ID:
7145 | Rating: 0
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I cannot understand. On charmm site seems that c37b1 is latest stable... Now the latest stable is c38b1 (and developmental is c39a1) Waiting for news |
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ID:
7154 | Rating: 0
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Yep... |
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ID:
7188 | Rating: 0
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15 february will be the next stable release of Charmm.... |
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ID:
7196 | Rating: 0
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Now the latest stable is c38b1 (and developmental is c39a1) As i wrote above, new stable version released: c38b2 (c39a2 beta) |
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ID:
7217 | Rating: 0
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I'm wondering why you are still using Charmm version c34a2, a developmental release from 2007. The latest developmental release is 37a1 and has not only performance enhancements, but OpenMM support (including GPU support). The latest stable release is from september 2011, c36b1, which also has performance enhancements and GPU support. BTW, I'm a bit confused when you say Charmm version 7, as it doesn't correspond to any known version numbering systems from http://www.charmm.org . Is there any reason that you are staying on a developmental release from 2007? |
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ID:
7377 | Rating: 0
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Message boards : Application Info : Update Charmm
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