Issues

• add final citation info

  documentation
  Task

  Becksteinlab/imdclient#154 · Filter by author orbeckst opened on Sep 3, 2026
  1

  

• allow MD engine tests to run outside repo

  CI/CD
  Task

  Becksteinlab/imdclient#153 · Filter by author orbeckst opened on Jul 30, 2026

• address code quality issues

  Becksteinlab/imdclient#150 · Filter by author orbeckst opened on Jul 24, 2026

• Documentation: Usage with GROMACS

  documentation
  Becksteinlab/imdclient#147 · Filter by author HeydenLabASU opened on Jul 7, 2026

• Code restructure to align single and multi threaded run

  Becksteinlab/imdclient#145 · Filter by author amruthesht opened on Jun 21, 2026

• IMDv2 in GROMACS requires client to set trate

  Becksteinlab/imdclient#143 · Filter by author amruthesht opened on Jun 19, 2026
  1

• IMDv2 support and tests for receiving positions

  Becksteinlab/imdclient#140 · Filter by author amruthesht opened on Jun 1, 2026

• new 0.3.0 release with zenodo

  release
  Task

  Becksteinlab/imdclient#125 · Filter by author orbeckst opened on May 13, 2026
  1

• make available sending control packets

  documentationenhancement
  Feature

  Becksteinlab/imdclient#123 · Filter by author orbeckst opened on Nov 21, 2025
  3

• IMD_WAIT sending support via memeber function

  Becksteinlab/imdclient#122 · Filter by author amruthesht opened on Nov 21, 2025

• Support IMDv2 packets types - IMD_KILL, IMD_IOERROR and IMD_MDCOMM

  Becksteinlab/imdclient#121 · Filter by author amruthesht opened on Nov 21, 2025
  1

• Enable free-threaded python in next release of imdclient when python 3.14 is installed

  Becksteinlab/imdclient#113 · Filter by author ljwoods2 opened on Sep 2, 2025

• Test for "bad shutdown" in integration tests

  Becksteinlab/imdclient#112 · Filter by author ljwoods2 opened on Aug 13, 2025

• document IMDFrame data structure

  documentation
  Becksteinlab/imdclient#110 · Filter by author orbeckst opened on Aug 4, 2025 · 1.0.0
  1

• add timing instrumentation

  Becksteinlab/imdclient#109 · Filter by author orbeckst opened on Jul 30, 2025
  2

• Intermediate logging in IMDClient

  Becksteinlab/imdclient#107 · Filter by author amruthesht opened on Jul 25, 2025
  

• Add tests for running IMDClient synchronously (multithreaded=False) or remove support

  testing
  Becksteinlab/imdclient#83 · Filter by author ljwoods2 opened on Jul 2, 2025 · 1.0.0

• Add tests for IMDv2 streams

  testing
  Becksteinlab/imdclient#82 · Filter by author ljwoods2 opened on Jul 2, 2025 · 1.0.0
  2

• Add link to official docs for NAMD once released

  documentation
  Becksteinlab/imdclient#80 · Filter by author ljwoods2 opened on Jun 30, 2025 · 1.0.0
  2

  

• Add link to official docs for GROMACS once released

  documentation
  Becksteinlab/imdclient#79 · Filter by author ljwoods2 opened on Jun 30, 2025 · 1.0.0

• doc improvements

  documentationhelp wanted
  Becksteinlab/imdclient#76 · Filter by author orbeckst opened on Jun 27, 2025 · 1.0.0

• Energies not being tested in NAMD, LAMMPS and GROMACS

  testing
  Becksteinlab/imdclient#72 · Filter by author amruthesht opened on Jun 24, 2025 · 1.0.0
  2

  

• Give the user an estimate of resource utilization for IMDClient

  enhancement
  Becksteinlab/imdclient#55 · Filter by author ljwoods2 opened on Mar 3, 2025

• Make and document an IMD server for serving written trajectories via IMD

  enhancement
  Becksteinlab/imdclient#48 · Filter by author ljwoods2 opened on Dec 20, 2024
  4

• Add support for applying forces to a simulation

  enhancement
  Becksteinlab/imdclient#45 · Filter by author ljwoods2 opened on Dec 17, 2024
  2