Re: [gmx-users] Analysis tools and triclinic boxes

2013-11-06 Thread Mark Abraham
Hi, They ought to, and we hope they do, but historically quality control of analysis tools was threadbare, there is no testing of that kind of thing now, and certainly no implied warranty. Especially at the existing price point! ;-) That comment could easily refer to (or be) an archaic code

[gmx-users] Analysis tools and triclinic boxes

2013-11-04 Thread Stephanie Teich-McGoldrick
Dear all, I am using gromacs 4.6.3 with a triclinic box. Based on the manual and mail list, it is my understanding that the default box shape in gromacs in a triclinic box. Can I assume that all the analysis tools also work for a triclinic box. Cheers, Stephanie -- gmx-users mailing list

Re: [gmx-users] Analysis tools and triclinic boxes

2013-11-04 Thread Justin Lemkul
On 11/4/13 1:29 PM, Stephanie Teich-McGoldrick wrote: Dear all, I am using gromacs 4.6.3 with a triclinic box. Based on the manual and mail list, it is my understanding that the default box shape in gromacs in a triclinic box. Can I assume that all the analysis tools also work for a triclinic