Re: [gmx-users] request for comments on profile.xvg (PMF) courve

Przemek Bartha wrote: Dear gmx users, my goal is to aquire a PMF courve of two amino-acids (ASP and LYS) of which one is pulled from the other. I followed Justin's tutorial on umbrella sampling. Here are the results. profile.xvg: http://przemekbartha.pl/upload/profile.png histo.xvg: http://p

[gmx-users] request for comments on profile.xvg (PMF) courve

Dear gmx users, my goal is to aquire a PMF courve of two amino-acids (ASP and LYS) of which one is pulled from the other. I followed Justin's tutorial on umbrella sampling. Here are the results. profile.xvg: http://przemekbartha.pl/upload/profile.png histo.xvg: http://przemekbartha.pl/upload/histo