Hello all, Because of the limitations in run time, my simulations have broken into three parts: one.trr, two.trr, and three.trr. Each run has its corresponding tpr file. The original tpr file (minimization step) was start.tpr. Now using trjconv for three.trr which tpr file I need to type after -s option?
trjconv -f three.trr -s start.tpr .... I am aware that the topology (information in the starting top file) will remain intact during simulation. I am wondering whether commands like trjconv read anything more than topology information (MD parameters, etc) from the -s option? In other words, in the above example replacing start.tprwith three.tpr will not change the outcome? Cheers, Terry
_______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [EMAIL PROTECTED] Can't post? Read http://www.gromacs.org/mailing_lists/users.php
