Re: [gmx-users] Umbrella Sampling (Justin Lemkul)

2016-06-09 Thread Nikhil Maroli
Hi already it is answered. run the gmx distance command to understand the problem. -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For

Re: [gmx-users] Umbrella Sampling (Justin Lemkul)

2016-06-09 Thread amitbehra
Hello all, I was practicing the umbrella sampling tutorial by Dr. Justin Lemkul. In my summary_distances.dat file there is only one column ( the column for centre of mass is missing ). Can anyone say what possible mistakes I must have done. Regards, Amit Behera Dept. of Chemical Engg., IISc,