Re: [gmx-users] two reference groups in pull code

Dear Chris: Thanks very much for the info. I will take a look at the source code and see how far I can go.;-) Bin On Apr 9, 2010, at 11:38 AM, chris.ne...@utoronto.ca wrote: Dear Bin: What you request is not currently possible with any distribution up to gmx-4.0.7 (I don't know if it is i

[gmx-users] two reference groups in pull code

Dear Bin: What you request is not currently possible with any distribution up to gmx-4.0.7 (I don't know if it is in the cvs). I have a modified version of gromacs-4.0.5 that will do this, but we are not distributing it yet. We may upload it in the future for incorporation into the main d

[gmx-users] two reference groups in pull code

Dear all: Reading about the gromacs4 manual, I couldn't figure out a way to apply two sets of pulling simultaneously in gromacs? I know you can specify a second group using pull_group2, but it has to use the same reference group in pull_group0, correct? Then I don't understand how one can a