Molecular dynamics simulation of the effect of pH on the adsorption of rhodamine laser dyes on TiO2hydroxylated surfaces

Said Hamad; Juan Ramón Sánchez-Valencia; Angel Barranco; José Antonio Mejías; Agustín R. González-Elipe

doi:10.1080/08927020903108083

Molecular dynamics simulation of the effect of pH on the adsorption of rhodamine laser dyes on TiO2hydroxylated surfaces

Molecular Simulation ◽

10.1080/08927020903108083 ◽

2009 ◽

Vol 35 (12-13) ◽

pp. 1140-1151 ◽

Cited By ~ 11

Author(s):

Said Hamad ◽

Juan Ramón Sánchez-Valencia ◽

Angel Barranco ◽

José Antonio Mejías ◽

Agustín R. González-Elipe

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Laser Dyes ◽

Effect Of Ph

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Molecular dynamics simulation and experimental validation of the effect of pH on protein desorption in hydrophobic charge induction chromatography

Molecular Simulation ◽

10.1080/08927022.2010.506511 ◽

2010 ◽

Vol 36 (13) ◽

pp. 1096-1103 ◽

Cited By ~ 7

Author(s):

Lin Zhang ◽

Guofeng Zhao ◽

Yan Sun

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Experimental Validation ◽

Dynamics Simulation ◽

Effect Of Ph ◽

Charge Induction ◽

Hydrophobic Charge Induction Chromatography

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Molecular dynamics simulation of human interleukin-4: comparison with NMR data and effect of pH, counterions and force field on tertiary structure stability

Molecular Simulation ◽

10.1080/08927020701613623 ◽

2007 ◽

Vol 33 (14) ◽

pp. 1143-1154 ◽

Cited By ~ 2

Author(s):

M. Winger ◽

H. Yu ◽

C. Redfield ◽

W. F. van Gunsteren

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Force Field ◽

Tertiary Structure ◽

Dynamics Simulation ◽

Interleukin 4 ◽

Structure Stability ◽

Effect Of Ph ◽

Nmr Data

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Effect of pH on the Aggregation of α-syn12 Dimer in Explicit Water by Replica-Exchange Molecular Dynamics Simulation

International Journal of Molecular Sciences ◽

10.3390/ijms160714291 ◽

2015 ◽

Vol 16 (12) ◽

pp. 14291-14304 ◽

Cited By ~ 1

Author(s):

Zanxia Cao ◽

Xiumei Zhang ◽

Lei Liu ◽

Liling Zhao ◽

Haiyan Li ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Replica Exchange ◽

Effect Of Ph ◽

Replica Exchange Molecular Dynamics ◽

Explicit Water

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Effect of pH on the Structure and Stability of Irisin, a Multifunctional Protein: Multispectroscopic and Molecular Dynamics Simulation Approach

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.132141 ◽

2021 ◽

pp. 132141

Author(s):

Rashid Waseem ◽

Anas Shamsi ◽

Mohd Shahbaz ◽

Tanzeel Khan ◽

Syed Naqui Kazim ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Simulation Approach ◽

Effect Of Ph ◽

Multifunctional Protein ◽

Structure And Stability

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The effect of pH on PAMAM dendrimer–siRNA complexation — Endosomal considerations as determined by molecular dynamics simulation

Biophysical Chemistry ◽

10.1016/j.bpc.2011.06.003 ◽

2011 ◽

Vol 158 (2-3) ◽

pp. 126-133 ◽

Cited By ~ 60

Author(s):

Defang Ouyang ◽

Hong Zhang ◽

Harendra S. Parekh ◽

Sean C. Smith

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Pamam Dendrimer ◽

Dynamics Simulation ◽

Effect Of Ph

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Effect of pH on the stability of hemochromatosis factor E: a combined spectroscopic and molecular dynamics simulation-based study

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2016.1189359 ◽

2016 ◽

Vol 35 (7) ◽

pp. 1582-1598 ◽

Cited By ~ 12

Author(s):

Parvez Khan ◽

Ashutosh Shandilya ◽

B. Jayaram ◽

Asimul Islam ◽

Faizan Ahmad ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Effect Of Ph ◽

Simulation Based ◽

The Stability

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Effect of pH on Size and Internal Structure of Poly(propylene imine) Dendrimers: A Molecular Dynamics Simulation Study

The Journal of Physical Chemistry B ◽

10.1021/acs.jpcb.8b04653 ◽

2018 ◽

Vol 122 (39) ◽

pp. 9250-9263 ◽

Cited By ~ 12

Author(s):

Shilpa Gupta ◽

Parbati Biswas

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Internal Structure ◽

Simulation Study ◽

Dynamics Simulation ◽

Effect Of Ph ◽

Poly Propylene

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Effect of pH on a phospholipid bilayer after phospholipase A2 enzyme action: a molecular dynamics simulation study

Chemistry and Physics of Lipids ◽

10.1016/j.chemphyslip.2007.06.073 ◽

2007 ◽

Vol 149 ◽

pp. S32

Author(s):

Katariina Lähdesmäki ◽

Artturi Koivuniemi ◽

Samuli Ollila ◽

Petri T. Kovanen ◽

Marja T. Hyvönen

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Phospholipase A2 ◽

Simulation Study ◽

Phospholipid Bilayer ◽

Dynamics Simulation ◽

Effect Of Ph ◽

Enzyme Action

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Rotational dynamics and velocity segregation in plastic KCIO4: a molecular dynamics simulation

Molecular Physics ◽

10.1080/00268979809482256 ◽

1998 ◽

Vol 93 (5) ◽

pp. 703-711

Author(s):

F. AFFOUARD ◽

PH. DEPONDT

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Rotational Dynamics ◽

Dynamics Simulation

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Molecular dynamics simulation of the dynamics of supercooled silica

Philosophical Magazine B ◽

10.1080/014186398259374 ◽

1998 ◽

Vol 77 (2) ◽

pp. 297-303 ◽

Cited By ~ 24

Author(s):

J. Horbach, W. Kob, K. Binder

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation

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