Translocation thermodynamics of linear and cyclic nonaarginine into model dppc bilayer via coarse-grained molecular dynamics simulation: Implications of pore formation and nonadditivity

Journal of Physical Chemistry B

Volumn 118, Issue 10, 2014, Pages 2670-2682

  Hu, Yuan ^a   Liu, Xiaorong ^a   Sinha, Sudipta Kumar ^a   Patel, Sandeep ^a  

^a UNIVERSITY OF DELAWARE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ENERGY BARRIERS; FREE ENERGY; MOLECULAR DYNAMICS; PEPTIDES; PORE SIZE; STABILIZATION; THERMODYNAMICS;

CELL-PENETRATING PEPTIDE; COARSE-GRAINED FORCE FIELDS; COARSE-GRAINED MOLECULAR DYNAMICS SIMULATIONS; CONFIGURATIONAL ENTROPY; ENTROPIC STABILIZATION; MOLECULAR DYNAMICS SIMULATIONS; POTENTIALS OF MEAN FORCES; STRUCTURAL MECHANISMS;

ATOMS;

CELL PENETRATING PEPTIDE; DIPALMITOYLPHOSPHATIDYLCHOLINE; LIPID BILAYER; PEPTIDE; POLYARGININE; SOLUTION AND SOLUBILITY; WATER;

CHEMISTRY; CONFORMATION; ENTROPY; LIPID BILAYER; MOLECULAR DYNAMICS; POROSITY; SOLUTION AND SOLUBILITY; THERMODYNAMICS;

1,2-DIPALMITOYLPHOSPHATIDYLCHOLINE; CELL-PENETRATING PEPTIDES; ENTROPY; LIPID BILAYERS; MOLECULAR CONFORMATION; MOLECULAR DYNAMICS SIMULATION; PEPTIDES; POROSITY; SOLUTIONS; THERMODYNAMICS; WATER;

EID: 84896295028     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp412600e     Document Type: Article

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