FAMUSAMM: An algorithm for rapid evaluat
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Eichinger, M.; Grubm�ller, H.; Heller, H.; Tavan, P.
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Article
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1997
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John Wiley and Sons
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English
⚖ 430 KB
👁 2 views
Within molecular dynamics simulations of protein᎐solvent systems the exact evaluation of long-range Coulomb interactions is computationally demanding and becomes prohibitive for large systems. Conventional truncation methods circumvent that computational problem, but are hampered by serious artifact