@@ -25,6 +25,8 @@ Specific IMDv3 options were added to GROMACS, as documented in the
2525GROMACS User Guide `Molecular dynamics parameters (.mdp options) `_ under
2626*Interactive Molecular Dynamics (IMD) *.
2727
28+ GROMACS does *not * support multiple concurrent connections to the same IMD port.
29+
2830In GROMACS, you will know that the simulation is ready and waiting for the
2931IMDClient when this line is printed to the terminal:
3032
4446----
4547The IMDv3 protocol has been implementaed in NAMD and will be made available through the
4648official NAMD release in the near future. It is currently available as a part of the
47- official NAMD GitLab repository - https://gitlab.com/tcbgUIUC/namd.
49+ official NAMD GitLab repository https://gitlab.com/tcbgUIUC/namd .
50+
51+ NAMD **does ** support multiple concurrent connections to the same IMD port.
4852
4953To use IMDv3 with NAMD, add the following lines to your NAMD configuration file:
5054
@@ -75,10 +79,12 @@ You are now ready to connect to the simulation engine with the IMDClient.
7579
7680LAMMPS
7781------
78- The IMDv3 protocol is part of the official LAMMPS distribution since ``patch_4Feb2025 ``.
79- It is available in the LAMMPS source code repository - https://github.com/lammps/lammps.
80- Information on using IMDv3 with LAMMPS can be found in the LAMMPS documentation
81- - https://docs.lammps.org/fix_imd.html
82+ The IMDv3 protocol is part of the official LAMMPS distribution since **patch_4Feb2025 **.
83+ It is available in the LAMMPS source code repository https://github.com/lammps/lammps.
84+ Information on using IMDv3 with LAMMPS can be found in the LAMMPS documentation for
85+ `fix_imd `_.
86+
87+ LAMMPS does *not * support multiple concurrent connections to the same IMD port.
8288
8389To use IMDv3 with LAMMPS, add the following lines to your LAMMPS input script:
8490
@@ -95,6 +101,8 @@ following terminal message:
95101
96102 You are now ready to connect to the simulation engine with a client.
97103
104+ .. _`fix_imd` : https://docs.lammps.org/fix_imd.html
105+
98106Using IMDClient
99107^^^^^^^^^^^^^^^
100108
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