Request for guidance on modifying HOOMD for Go model 12-10 LJ potential

[Boran-Zhao]

Dear all,
I'm new to HOOMD and want to run a Go model simulation, which uses a 12-10 Lennard-Jones (LJ) potential not directly available in HOOMD.
We can use the LJ potential by a command in hoomd through a command in python script (hoomd.md.pair.LJ or hoomd.md.pair.LJ0804). In this way, I imitated the EvaluaterPairLJ.h file in the source code and wrote an EvaluaterPairLJ1210.h file.
I hope to compile the modified source code so that I can call hoomd.md.pair.LJ1210 to use this modify 12-10 LJ potential.

         But I think I still need to modify its files to complete this task. Can someone give me some guidance.

Best
EvaluatorPairLJ1210.txt

[Boran-Zhao]

I expressed this sentence inaccurately, “But I think I still need to modify its files to complete this task. Can someone give me some guidance.”
To be more specific:
I still need to modify which parts of the source files? Can someone give me some guidance.

[joaander]

See https://github.com/glotzerlab/hoomd-md-pair-template

[Boran-Zhao]

Thanks for your reply！

[Boran-Zhao]

I use hoomd.hpmc.pair.OPP to achieve the 12-10LJ potential, in which I no longer need to install additional plugins.

[joaander]

Thanks for sharing your solution!