Re: [gmx-users] Visualize Protein ligand complex after simulation

2013-01-28 Thread Erik Marklund
Short answer is to inspect your complex with VMD or Pymol (or some other viewer). Pymol takes pdb input, so unless your structure is contained in a pdb file you must convert it with e.g. trjconv first. If you want a single frame you need to extract one form your trajectory, or, if the final

Re: [gmx-users] Visualize Protein ligand complex after simulation

2013-01-28 Thread Justin Lemkul
On 1/28/13 9:30 AM, Sainitin Donakonda wrote: Hello, Recently i started working on molecular dynamics on my protein ligand complex using gromacs i successfully did simulation but i dont know how to visualize this protein-ligand complex this after MD simulation Can any body tell me how to do