Macromolecules

[mms]

Hi Professor,

Is there a maximum number of atoms in the molecule.def? I have a macromolecule that has more than 1000 atoms and it is giving me a segmentation fault error

[David Dubbeldam]

In principle there is no limit. But Monte Carlo is limited to small molecules, usually molecules of 1-20 atoms. 30 atoms is already considered very, very large.