Sampling and convergence in free energy calculations of protein-ligand interactions: The binding of triphenoxypyridine derivatives to factor Xa and trypsin

Author: Villa Alessandra   Zangi Ronen   Pieffet Gilles   Mark Alan E.  

Publisher: Springer Publishing Company

ISSN: 0920-654X

Source: Journal of Computer-Aided Molecular Design, Vol.17, Iss.10, 2003-10, pp. : 673-686

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