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                                            savenkom

Crashing while adding a new hill in multiple walkers metadynamics - GROMACS

I was using GROMACS 2024.3 and Colvars version indicated in md.log is the 2023-12-04 (patch 2). This set-up is coming directly from spack and default installation and I added nothing...

Crashing while adding a new hill in multiple walkers metadynamics - GROMACS

Sorry for answering with delay. The error itself was indicated as terminate called after throwing an instance of 'gmx::InternalError' what(): Error in collective variables module. If you backtrace with GDB...