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GROMACS: A message-passing parallel molecular dynamics implementation
H Berendsen, D Van Der Spoel, and R Van Drunen
Computer Physics Communications 91 (1-3), 43-56 (02 Sep 1995)
Posted by christianjensen and 1 other to MD dynamics Molecular gromacs on Thu Dec 14 2006 at 10:49 UTC | info | related
 
Hydration Thermodynamic Properties of Amino Acid Analogues: A Systematic Comparison of Biomolecular Force Fields and Water Models
Berk Hess and Nico Van Der Vegt
Journal of Physical Chemistry B 110 (35), 17616 (2006)
info:doi/10.1021/jp0641029
Posted by christianjensen to comparison field force gromacs 53a6 on Thu Dec 14 2006 at 10:25 UTC | info | related
 
A biomolecular force field based on the free enthalpy of hydration and solvation: The GROMOS force-field parameter sets 53A5 and 53A6
A biomolecular force field based on the free enthalpy of hydration and solvation the GROMOS forcefield parameter sets 53A5 and 53A6
Chris Oostenbrink et al.
Journal of Computational Chemistry 25 (13), 1656 (2004)
info:doi/10.1002/jcc.20090
Posted by christianjensen and 1 other to force gromacs 53a6 field on Thu Dec 14 2006 at 10:20 UTC | info | related
 
Biomolecular Modeling: Goals, Problems, Perspectives
Angewandte Chemie International Edition 45 (25), 4064 (2006)
info:doi/10.1002/anie.200502655
Posted by christianjensen to simulation MD gromacs on Tue Nov 21 2006 at 14:53 UTC | info | related

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