Accelerated molecular dynamics in lammps

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1

Dear Users,
I would like to perform accelerated molecular dynamics simulations (J. Chem. Phys., 120(24):11919-11929, 2004) of my protein in lammps.
I did not find any tutorial about aMD in lammps.

Is it possible to implement aMD in lammps?
Please let me know more details about it.

Thanks

MKD

2

Dear Users,
I would like to perform accelerated molecular dynamics simulations (J. Chem. Phys., 120(24):11919-11929, 2004) of my protein in lammps.

why not use NAMD?

I did not find any tutorial about aMD in lammps.

because there isn’t any. first you would have to implement the functionality.

Is it possible to implement aMD in lammps?

sure, but depends on your c++ programming skills.

axel.