TuckermanGroup/PINY — pull request #56 by OndrejMarsalek (2014-04-21 16:56:43+00:00)
Title: Write output also at step 0

This change does standard screen output as well as file output for classical MD also at frame 0, while keeping the rest of the output the same. If it can be merged, I will do the same for PIMD as well.

Closes #54.