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David van der Spoel

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09/17/2020

10:43 AM GROMACS Revision e16b0606: Add release notes
Change-Id: I5320ad4ee975a37e5fe57de1f26935db3f3cc0b4

03/03/2020

02:27 PM GROMACS Task #1852: Remove group scheme
I cannot seem to find anything on gerrit, maybe because it is private?

02/26/2020

09:25 AM GROMACS Revision 4243c39b: Made gentop print warnings only when verbose is on.
Change-Id: Ice5d98b92a1f9cdcba7608a34a9051ab392cd631

02/22/2020

10:15 PM GROMACS Bug #3384 (Resolved): Inconsisten labels in distance restraints can crash gmx disre
Applied in changeset commit:45752960a79a8cfa585af0da7ae641aab58637c0.
10:00 PM GROMACS Revision 45752960: Fixed bug in gmx disre due to inconsistency in input.
The gmx disre program used the labels in the distance restraint entries
(see manual) as an index in internal arrays. ...

02/20/2020

10:00 PM GROMACS Bug #3375 (Resolved): Orires consistency check too strict
Applied in changeset commit:c9a55080a79dfe508962ef2f65156119828f9559.
10:07 AM GROMACS Revision d4eeff04: Fixed bug in orires code that was checking too strict.
Fixes #3375
Change-Id: I0f64b386477b9a72f18c95fd977ac8cf5dbeeccd
08:45 AM GROMACS Revision c9a55080: Fixed bug in orires code that was checking too strict.
Added one test to see that input is accepted.
Fixes #3375
Change-Id: I0f64b386477b9a72f18c95fd977ac8cf5dbeeccd

02/19/2020

09:29 PM GROMACS Revision 59528404: Made gentop read mol2, xyz files.
Changed the file reading option in gentop to -f only. This is
processed as a string, not a file option. Since all fil...

02/18/2020

10:17 PM GROMACS Bug #3386 (Closed): gmx disre crashed when number of pairs larger than number of restraints

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