Unraveling the Conformational Determinants of Peptide Dendrimers Using Molecular Dynamics Simulations

Luís C. S. Filipe; Miguel Machuqueiro; Tamis Darbre; António M. Baptista

doi:10.1021/ma401574b

Unraveling the Conformational Determinants of Peptide Dendrimers Using Molecular Dynamics Simulations

Macromolecules ◽

10.1021/ma401574b ◽

2013 ◽

Vol 46 (23) ◽

pp. 9427-9436 ◽

Cited By ~ 6

Author(s):

Luís C. S. Filipe ◽

Miguel Machuqueiro ◽

Tamis Darbre ◽

António M. Baptista

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Peptide Dendrimers ◽

Dynamics Simulations

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Correction to Unfolding the Conformational Behavior of Peptide Dendrimers: Insights from Molecular Dynamics Simulations

Journal of the American Chemical Society ◽

10.1021/ja311198h ◽

2012 ◽

Vol 134 (49) ◽

pp. 20207-20207 ◽

Cited By ~ 1

Author(s):

Luís C. S. Filipe ◽

Miguel Machuqueiro ◽

António M. Baptista

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Conformational Behavior ◽

Peptide Dendrimers ◽

Dynamics Simulations

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Unfolding the Conformational Behavior of Peptide Dendrimers: Insights from Molecular Dynamics Simulations

Journal of the American Chemical Society ◽

10.1021/ja111001v ◽

2011 ◽

Vol 133 (13) ◽

pp. 5042-5052 ◽

Cited By ~ 28

Author(s):

Luís C. S. Filipe ◽

Miguel Machuqueiro ◽

António M. Baptista

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Conformational Behavior ◽

Peptide Dendrimers ◽

Dynamics Simulations

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Structure of phosphorus-selenium glasses: results from ab initio molecular dynamics simulations

Molecular Physics ◽

10.1080/002689700162045 ◽

2000 ◽

Vol 98 (11) ◽

pp. 701-707

Author(s):

Alessandro Sergi, Mauro Ferrario, Francesco Bu

Keyword(s):

Molecular Dynamics ◽

Ab Initio ◽

Molecular Dynamics Simulations ◽

Ab Initio Molecular Dynamics ◽

Dynamics Simulations

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Tracer diffusion in perfectly aligned liquid crystalline phases Kinetic theory and molecular dynamics simulations

Molecular Physics ◽

10.1080/00268979709482789 ◽

1997 ◽

Vol 91 (6) ◽

pp. 993-1003 ◽

Cited By ~ 1

Author(s):

ANJALI KHARE ◽

DAVID KOFKE ◽

GLENN EVANS

Keyword(s):

Molecular Dynamics ◽

Kinetic Theory ◽

Molecular Dynamics Simulations ◽

Liquid Crystalline ◽

Tracer Diffusion ◽

Crystalline Phases ◽

Liquid Crystalline Phases ◽

Dynamics Simulations

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ERRATUM Molecular dynamics simulations of liquid crystal phases using atomistic potentials

Molecular Physics ◽

10.1080/002689798167430 ◽

1998 ◽

Vol 95 (1) ◽

pp. 121-121

Author(s):

CARL MCBRIDE MARK R. WILSON JUDITH A. K.

Keyword(s):

Molecular Dynamics ◽

Liquid Crystal ◽

Molecular Dynamics Simulations ◽

Crystal Phases ◽

Dynamics Simulations ◽

Liquid Crystal Phases

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Nonequilibrium Molecular Dynamics Simulations of 3-Methylhexane: The Effect of Inter- and Intramolecular Potential Models on Simulated Viscosity

The Journal of Physical Chemistry A ◽

10.1021/jp971476g ◽

1997 ◽

Vol 101 (27) ◽

pp. 5026-5026

Author(s):

Maija Lahtela ◽

Tapani A. Pakkanen ◽

Richard L. Rowley

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Nonequilibrium Molecular Dynamics ◽

Potential Models ◽

Dynamics Simulations

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Assessment of all-atom potentials for modeling membranes: molecular dynamics simulations of solid and liquid alkanes and crystals of phospholipid fragments

Journal de Chimie Physique ◽

10.1051/jcp/1997941482 ◽

1997 ◽

Vol 94 ◽

pp. 1482-1502 ◽

Cited By ~ 27

Author(s):

DJ Tobias ◽

K Tu ◽

ML Klein

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Dynamics Simulations ◽

Liquid Alkanes

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Molecular Dynamics Simulations of Retrograde Condensation in Nanoporous Shale

Proceedings of the 3rd Unconventional Resources Technology Conference ◽

10.15530/urtec-2015-2172738 ◽

2015 ◽

Cited By ~ 1

Author(s):

William R. Welch ◽

Mohammad Piri

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Retrograde Condensation ◽

Dynamics Simulations

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MOLECULAR DYNAMICS SIMULATIONS OF RAYLEIGH AND FIRST WIND-INDUCED BREAKUP

Atomization and Sprays ◽

10.1615/atomizspr.2011002906 ◽

2011 ◽

Vol 21 (4) ◽

pp. 275-281 ◽

Cited By ~ 4

Author(s):

Kurt F. Ludwig ◽

Michael Micci

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Dynamics Simulations

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MOLECULAR DYNAMICS SIMULATIONS OF ATOMIZATION AND SPRAY PHENOMENA

Atomization and Sprays ◽

10.1615/atomizspr.v11.i4.40 ◽

2001 ◽

Vol 11 (4) ◽

pp. 351-363 ◽

Cited By ~ 7

Author(s):

Teresa L. Kaltz ◽

Lyle N. Long

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Dynamics Simulations

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