Re: [gmx-users] make index groups with make_ndx

Thank you very much for your answer. I managed it now to get the right index groups. > The selections are boolean (like a search). > > So to include both 6 and 7 you would use 6 | 7 (make the selection of 6 or > 7) > > so you probably want something like ! res65 | ! res 6 etc. > > > On 2012-09-18

Re: [gmx-users] make index groups with make_ndx

The selections are boolean (like a search). So to include both 6 and 7 you would use 6 | 7 (make the selection of 6 or 7) so you probably want something like ! res65 | ! res 6 etc. On 2012-09-18 10:56:14AM +0200, reising...@rostlab.informatik.tu-muenchen.de wrote: > Hi everybody, > I want to

[gmx-users] make index groups with make_ndx

Hi everybody, I want to make two index groups for my protein. The first one should contain the whole protein except of the residues : TYR65, Pro6, Phe7, Tyr61, Arg64, Tyr80 I tried it with the arguments: "protein" &! res 65 &! res 6 &! res 7 &! res 61 &! res 64 &! res 80 "protein" &! res 65 6 7 6