Moldy, a Molecular Dynamics Program

October 11, 2008 Leave a comment

These days I have tested some molecular dynamics simulation programs, well GNU and similar licensed codes.  I begin with Moldy with seems easy to play and learn some basics tips of classical molecular dynamics. The code is wrote in C++ so for fortran lovers could be some different philosophy to do modifications but include new pair potentials isn’t difficult and the manual covert this and other topics. Well, I only see difficult use to study non-homogeneous systems, for example, isn’t direct construct the contour conditions for a interface study but its possible as in the Moldy-List is explained.

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