Hi,
please, is there a project or a feature of Espresso running Brownian dynamics?
I figured out, that just setting mass to zero doesn't work :-)
In the integrator (integrate.cpp) there is also velocity scaling which goes
to infinity with the mass zero..
Kind regards,
Dusan
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Faculté de biologie et de médecine
Center for Integrative Genomics
GENOPODE UNIL-SORGE
Université de Lausanne
CH1015 Lausanne, Suisse [+]
Polymer Institute of the Slovak Academy of Sciences
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tel: +421 2 3229 4321