i need you help~
i am trying to introduce hydrogen bond constraints.
something like this:
Let O on residue 1 and N on residue 10 form hydrogen bond.
Let N on residue 1 and O on residue 20 form hydrogen bond.
i had tried to place the two hydrogen bond atoms close as distance constraint.
but mostly the distance constraint is not enough
so i want to calculate hydrogen bond as a constraint.
i had tried to use hbonds.HBondSet().
but i can only display hydrogen bond state uwing hbonds.HBondSet().show()
and cannot get the information as string or other formats.
how can i get the hydrogen bond states between two atoms?
i am welcoming any suggestions!
thank you in advance.