Closed Jesse-V closed 11 years ago
Atoms should move smoothly from snapshot to snapshot. Bonds, aligned and oriented to the pairs of atoms they connect, should of course follow.
The numbers check out, I think this is done. I just need to get a WU with more than one checkpoint so that I can test this!
I finally picked up an core a4 WU, and IT WORKS! :D :D
Atoms should move smoothly from snapshot to snapshot. Bonds, aligned and oriented to the pairs of atoms they connect, should of course follow.