I have a question. In the article I found description like that:
OPLS-AA Torsional Parameters ( kcal / mol )
for Carbohydrates.
Type V 1 V 2 V 3
H-C-C-H 0.0 0.0 0.318
H-C-C-C 0.0 0.0 0.366
And for example in gromacs I have much more numbers (six)
[ dihedrals ]
; PROPER DIHEDRAL ANGLES
; ai aj ak al funct c0 c1 c2 c3 c4 c5
48 43 38 42 3 -2.197 5.201 0.527 -3.531 -0.000 0.000
49 45 42 38 3 -2.197 5.201 0.527 -3.531 -0.000 0.000
Fifth and sixth number is always 0 in my topology, but I have four other numbers, so how to compare this numbers from article to this from topology file?