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Hi!
I'm simulating a 10-residue protein. My trajectory files record these residues in terms of x, y, z coordinates.
Can Gromacs convert these coordinates into dihedral angles for each residue?
For example,
Residue 1: SinPhi = 20, Sin Psi =25, Cos Phi = 15, Sin Phi =75
Residue 2: etc .. etc
Regards,
Adam
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