Re: [gmx-users] 1-4 LJ interactions

2020-04-01 Thread Andrey Gurtovenko
/20 12:59 PM, Andrey Gurtovenko wrote: > > Dear All, > > > > Recently I realized that I don't fully understand what should be done > > in Gromacs to account for 1-4 LJ interactions. > > > > According to the manual: > > > > "gen-pairs is for pair

[gmx-users] 1-4 LJ interactions

2020-03-31 Thread Andrey Gurtovenko
teractions are NOT accounted for. Can someone comment on this? If I am right, maybe it is worth to clarify this point in the manual? with kind regards, Andrey Gurtovenko -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List befo