OpenMM does not give progress for minimization, just wait... tetraloop_mdr.pdb ... Traceback (most recent call last): File "/home/ubuntu/rna-tools/rna_tools/tools/md/rna_minimize.py", line 42, in pdb = PDBFile(f) File "/home/ubuntu/miniconda3/lib/python3.8/site-packages/openmm/app/pdbfile.py", line 163, in __init__ self.positions = self._positions[0] IndexError: list index out of range DONE!