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"Enabling grand-canonical Monte Carlo: Extending the flexibility of GROMACS ..."
René Pool et al. (2012)
- René Pool, Jaap Heringa, Martin Hoefling, Roland Schulz, Jeremy C. Smith, K. Anton Feenstra:
Enabling grand-canonical Monte Carlo: Extending the flexibility of GROMACS through the GromPy python interface module. J. Comput. Chem. 33(12): 1207-1214 (2012)
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