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Messages - mms

#1
General / Macromolecules
December 09, 2024, 07:29:04 AM
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
#2
General / Monte carlo on biomolecules
November 28, 2024, 09:27:52 AM
Hi Prof. Dubbeldam,

I am new to RASPA, so so please forgive any oversights and ignorance from my part.

Can raspa do monte carlo simulations on biomolecules like protein or rna? I want to study the binding of ions using Monte carlo. If not, can you please suggest me another software?
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