Error while loading data

[Maxim-93]

Hi there,

I'm having some issues loading trajectories into PyContact and keep receiving the following error message:

"Error while loading data: Probably you specified an atom selection with 0 atoms or invalid input files."

What's confusing about this, is that I've checked the files and atom selections by using MDAnalysis beforehand, so I know that the files and selections are fine...

Any idea what what else could be the issue/ how I might solve this?

Cheers!

[maxscheurer]

Hi,

what kind of topology/trajectory file are you trying to load? psf + dcd file?
I should really fix this error message at some point, the "or" statement is not that helpful...

[Maxim-93]

I’ve tried both gro and tpr files as the the topology, with corresponding .xtc file for trajectory