[gmx-users] calculating dihedral properties

2013-09-25 Thread Anna MARABOTTI
Dear all, I would like to calculate how three dihedrals in my protein are evolving during the simulation time, but I don't understand which is the correct command to do. In particular, I would like to know: - what is the value of a specified dihedral (in degrees) - if this value changes

Re: [gmx-users] calculating dihedral properties

2013-09-25 Thread Justin Lemkul
On 9/25/13 12:08 PM, Anna MARABOTTI wrote: Dear all, I would like to calculate how three dihedrals in my protein are evolving during the simulation time, but I don't understand which is the correct command to do. In particular, I would like to know: - what is the value of a specified