20 Dec
2011
20 Dec
'11
7:29 p.m.
I'm trying to analyse Hbond formation during a 2ns AMBER trajectory involving receptor ligand complex. The trajectory loads as expected. I've selected the ligand and I checked the boxes "Only find H-bonds with at lease one end selected" and "Write information to file" . The output hbond.info contains information of a single frame. My question is whether there's a way by means of which information of ALL frames can be printed out. Many thanks and best regards George