scholarly journals All-atom polarizable force field for DNA based on the classical drude oscillator model

2014 ◽  
Vol 35 (16) ◽  
pp. 1219-1239 ◽  
Author(s):  
Alexey Savelyev ◽  
Alexander D. MacKerell
Keyword(s):  
Force Field ◽  
Oscillator Model ◽  
Polarizable Force Field

scholarly journals An Empirical Polarizable Force Field Based on the Classical Drude Oscillator Model: Development History and Recent Applications

2016 ◽  
Vol 116 (9) ◽  
pp. 4983-5013 ◽  
Author(s):  
Justin A. Lemkul ◽  
Jing Huang ◽  
Benoît Roux ◽  
Alexander D. MacKerell
Keyword(s):  
Force Field ◽  
Model Development ◽  
Oscillator Model ◽  
Polarizable Force Field ◽  
Development History

Parametrizing a polarizable force field from ab initio data. I. The fluctuating point charge model

1999 ◽  
Vol 110 (2) ◽  
pp. 741-754 ◽  
Author(s):  
Jay L. Banks ◽  
George A. Kaminski ◽  
Ruhong Zhou ◽  
Daniel T. Mainz ◽  
B. J. Berne ◽  
...  
Keyword(s):  
Force Field ◽  
Ab Initio ◽  
Point Charge ◽  
Point Charge Model ◽  
Polarizable Force Field ◽  
Charge Model

Molecular Dynamics Study of Hydration in Ethanol−Water Mixtures Using a Polarizable Force Field†

2005 ◽  
Vol 109 (14) ◽  
pp. 6705-6713 ◽  
Author(s):  
Sergei Yu. Noskov ◽  
Guillaume Lamoureux ◽  
Benoît Roux
Keyword(s):  
Molecular Dynamics ◽  
Force Field ◽  
Polarizable Force Field
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