13th May, bi-weekly GROMACS meeting - morning edition

Dear all,

Next GROMACS developer meeting will be 2026-05-13T09:00:00Z on zoom. Everybody is welcome.

If there are any specific topics you wish to discuss, just add to the agenda by editing the post Tuesday before the call. A defined agenda help that interested people will join the call.

Agenda:

  • LAPACK and FPE masking * !5893 seems ready but not merged. Alexey Shvetsov
  • Possible migration TAF to C++ version of TrajectoryFrame (partial * !5884). Alexey Shvetsov
  • <very brief description of the topic, and link to information on the ideas or to the issue> < who you are>
  • Open questions

We usually reserve in total 20 min for each discussion topic. We suggest to use 5-10 min to present the problem and focus on a question that you want to address.

Note this is a wiki post: Everybody in the developer category can edit!
To be able to post on the developers category, you need to be member of the forum. Send a request to join the GROMACS developers group using the following link

Dear all,
Next GROMACS developer meeting will be Wednesday, May 13, 2026 9:00 AM

Agenda:

  • LAPACK and FPE masking * !5893 Alexey Shvetsov
  • Possible migration TAF to C++ version of TrajectoryFrame (partial * !5884). Alexey Shvetsov
  • Open questions

Everybody is welcome.

Below zoom details

See you soon

Where: Join our Zoom Meeting (magic link)

Meeting ID: 692 7708 9234
Password: gmxdevs

Join by SIP:
69277089234@zoom.nordu.net

We also discussed:

the following draft on implementation virtual sites Draft: Implement virtual sites on GPU (!5977) · Merge requests · GROMACS / GROMACS · GitLab