Entering edit mode
2.1 years ago
Josefina
•
0
Hello, I'm running AutoDock Tools on Windows 11. Whenever I want to choose torsion in currently selected residues, I get this mistakes. Someone has some idea or suggestion of what could be the problem? Thank you!
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\ViewerFramework\VF.py", line 941, in tryto
result = command( *args, **kw )
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\AutoDockTools\autoflexCommands.py", line 369, in doit
map(self.setAutoFlexFields, flex_residues)
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\AutoDockTools\autoflexCommands.py", line 414, in setAutoFlexFields
rotatables = rbs.select(bondlist)
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\MolKit\bondSelector.py", line 534, in select
rotatable = BondOrderBondSelector().select(bnds,1)
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\MolKit\bondSelector.py", line 511, in select
bo.assignBondOrder(allAts, allAts.bonds[0], rf)
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\PyBabel\bo.py", line 82, in assignBondOrder
self.assign_bond_order2(atoms, bonds, rings)
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\PyBabel\bo.py", line 243, in assign_bond_order2
self.connect_the_dots(0,0)
File "C:\Program Files (x86)\MGLTools-1.5.7\lib\site-packages\PyBabel\bo.py", line 377, in connect_the_dots
self.connect_the_dots(atom+1,0)
Hi, Have you solved this? I get the same error now.