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51

A Molecular Mechanism of Hysteresis in Clay Swelling

Tim J. Tambach, Peter G. Bolhuis, Berend Smit

Journal:

Angewandte Chemie International Edition

Year:

2004

Language:

english

File:

PDF, 229 KB

english, 2004

52

A Computational Method To Characterize Framework Aluminum in Aluminosilicates

Elena García-Pérez, David Dubbeldam, Bei Liu, Berend Smit, Sofía Calero

Journal:

Angewandte Chemie International Edition

Year:

2007

Language:

english

File:

PDF, 308 KB

english, 2007

53

Lithium-Doped 3D Covalent Organic Frameworks: High-Capacity Hydrogen Storage Materials

Dapeng Cao, Jianhui Lan, Wenchuan Wang, Berend Smit

Journal:

Angewandte Chemie International Edition

Year:

2009

Language:

english

File:

PDF, 508 KB

english, 2009

54

ChemInform Abstract: Entropy Effects During Sorption of Alkanes in Zeolites

Rajamani Krishna, Berend Smit, Sofia Calero

Journal:

Year:

2002

File:

PDF, 25 KB

2002

55

ChemInform Abstract: Carbon Dioxide Capture: Prospects for New Materials

Deanna M. D'Alessandro, Berend Smit, Jeffrey R. Long

Journal:

Year:

2010

File:

PDF, 14 KB

2010

56

Molecular simulations of adsorption isotherms of small alkanes in FER-, TON-, MTW- and DON-type zeolites

Jean-Marie B Ndjaka, Gooitzen Zwanenburg, Berend Smit, Merijn Schenk

Journal:

Microporous and Mesoporous Materials

Year:

2004

Language:

english

File:

PDF, 792 KB

english, 2004

57

Mesoscopic models of biological membranes

Maddalena Venturoli, Maria Maddalena Sperotto, Marieke Kranenburg, Berend Smit

Journal:

Physics Reports

Year:

2006

Language:

english

File:

PDF, 5.47 MB

english, 2006

58

Computer simulations of surfactant structures

Sami Karaborni, Berend Smit

Journal:

Current Opinion in Colloid & Interface Science

Year:

1996

Language:

english

File:

PDF, 498 KB

english, 1996

59

Chemical Modeling: From Atoms to Liquids. Alan Hinchliffe (Ed.), Wiley, 1999, 395 pp., £23.50 paperback, £55.00 hardback, ISBN 0-471-99903-2.

Journal:

Chemical Engineering Journal

Year:

2000

Language:

english

File:

PDF, 8 KB

english, 2000

60

The Role of Myocardial KATP-Channel Blockade in the Protective Effects of Glibenclamide against Ischaemia in the Rat Heart

Roger J. Legtenberg, Gerard A. Rongen, Ralph J. F. Houston, Berend Oeseburg, Paul Smits

Journal:

Basic & Clinical Pharmacology & Toxicology

Year:

2002

Language:

english

File:

PDF, 133 KB

english, 2002

61

Simulating the critical behaviour of complex fluids

Siepmann, J. IIja, Karaborni, Sami, Smit, Berend

Journal:

Year:

1993

File:

PDF, 328 KB

1993

62

Towards a molecular understanding of shape selectivity

Smit, Berend, Maesen, Theo L. M.

Journal:

Year:

2008

Language:

english

File:

PDF, 822 KB

english, 2008

63

Addressing Challenges of Identifying Geometrically Diverse Sets of Crystalline Porous Materials

Martin, Richard Luis, Smit, Berend, Haranczyk, Maciej

Journal:

Journal of Chemical Information and Modeling

Year:

2012

Language:

english

File:

PDF, 1.29 MB

english, 2012

64

Grand canonical Monte Carlo simulations of chain molecules: adsorption isotherms of alkanes in zeolites

Journal:

Molecular Physics

Year:

1995

Language:

english

File:

PDF, 1013 KB

english, 1995

65

Doping of Alkali, Alkaline-Earth, and Transition Metals in Covalent-Organic Frameworks for Enhancing CO2 Capture by First-Principles Calculations and Molecular Simulations

Lan, Jianhui, Cao, Dapeng, Wang, Wenchuan, Smit, Berend

Journal:

Year:

2010

Language:

english

File:

PDF, 5.26 MB

english, 2010

66

Efficient Monte Carlo Simulations of Gas Molecules Inside Porous Materials

Kim, Jihan, Smit, Berend

Journal:

Journal of Chemical Theory and Computation

Year:

2012

Language:

english

File:

PDF, 2.40 MB

english, 2012

67

Alkane hydrocracking: shape selectivity or kinetics?

Theo L.M Maesen, Sofia Calero, Merijn Schenk, Berend Smit

Journal:

Journal of Catalysis

Year:

2004

Language:

english

File:

PDF, 452 KB

english, 2004

68

The selectivity of n-hexane hydroconversion on MOR-, MAZ-, and FAU-type zeolites

Sofia Calero, Merijn Schenk, David Dubbeldam, Theo L.M. Maesen, Berend Smit

Journal:

Journal of Catalysis

Year:

2004

Language:

english

File:

PDF, 263 KB

english, 2004

69

Understanding cage effects in the n-alkane conversion on zeolites

Theo L.M. Maesen, Edith Beerdsen, Sofia Calero, David Dubbeldam, Berend Smit

Journal:

Journal of Catalysis

Year:

2006

Language:

english

File:

PDF, 5.58 MB

english, 2006

70

Shape-selective n-alkane hydroconversion at exterior zeolite surfaces

Theo L.M. Maesen, Rajamani Krishna, Jasper M. van Baten, Berend Smit, Sofia Calero, Juan Manuel Castillo Sanchez

Journal:

Journal of Catalysis

Year:

2008

Language:

english

File:

PDF, 735 KB

english, 2008

71

Spike protein assembly into the coronavirion: exploring the limits of its sequence requirements

Berend Jan Bosch, Cornelis A.M. de Haan, Saskia L. Smits, Peter J.M. Rottier

Journal:

Year:

2005

Language:

english

File:

PDF, 1.40 MB

english, 2005

72

Effects of sulfonylurea derivatives on ischemia-induced loss of function in the isolated rat heart

Roger J Legtenberg, Ralph J.F Houston, Berend Oeseburg, Paul Smits

Journal:

European Journal of Pharmacology

Year:

2001

Language:

english

File:

PDF, 199 KB

english, 2001

73

Glibenclamide attenuates ischemia-induced acidosis and loss of cardiac function in rats

Roger J Legtenberg, Ralph J.F Houston, Arend Heerschap, Berend Oeseburg, Paul Smits

Journal:

European Journal of Pharmacology

Year:

2002

Language:

english

File:

PDF, 271 KB

english, 2002

74

Shape selectivity through entropy

Merijn Schenk, Sofia Calero, Theo L.M Maesen, Thijs J.H Vlugt, Lucas L van Benthem, Martijn G Verbeek, Benoit Schnell, Berend Smit

Journal:

Journal of Catalysis

Year:

2003

Language:

english

File:

PDF, 397 KB

english, 2003

75

High-pressure liquid phase hydroconversion of heptane/nonane mixtures on Pt/H-Y zeolite catalyst

Joeri F.M. Denayer, Refik A. Ocakoglu, Ward Huybrechts, Bruno Dejonckheere, Pierre Jacobs, Sofia Calero, Rajamani Krishna, Berend Smit, Gino V. Baron, Johan A. Martens

Journal:

Journal of Catalysis

Year:

2003

Language:

english

File:

PDF, 271 KB

english, 2003

76

Molecular Simulation of CO2/H2 Mixture Separation in Metal-organic Frameworks: Effect of Catenation and Electrostatic Interactions

Qingyuan YANG, Qing XU, Bei LIU, Chongli ZHONG, Smit Berend

Journal:

Chinese Journal of Chemical Engineering

Year:

2009

Language:

english

File:

PDF, 836 KB

english, 2009

77

Physiological insulin concentrations protect against ischemia-induced loss of cardiac function in rats

Roger J Legtenberg, Ralph J.F Houston, Berend Oeseburg, Paul Smits

Journal:

Comparative Biochemistry and Physiology Part A: Molecular & Integrative Physiology

Year:

2002

Language:

english

File:

PDF, 163 KB

english, 2002

78

Effectiveness of a Minimal Intervention for Stress-related mental disorders with Sick leave (MISS); study protocol of a cluster randomised controlled trial in general practice [ISRCTN43779641]

Ingrid M Bakker, Berend Terluin, Harm WJ van Marwijk, Chad M Gundy, Johannes H Smit, Willem van Mechelen, Wim AB Stalman

Journal:

BMC Public Health

Year:

2006

Language:

english

File:

PDF, 283 KB

english, 2006

79

Ab initio carbon capture in open-site metal–organic frameworks

Dzubak, Allison L., Lin, Li-Chiang, Kim, Jihan, Swisher, Joseph A., Poloni, Roberta, Maximoff, Sergey N., Smit, Berend, Gagliardi, Laura

Journal:

Nature Chemistry

Year:

2012

Language:

english

File:

PDF, 435 KB

english, 2012

80

Adsorption and separation of linear and branched alkanes on carbon nanotube bundles from configurational-bias Monte Carlo simulation

Jiang, Jianwen, Sandler, Stanley, Schenk, Merijn, Smit, Berend

Journal:

Physical Review B

Year:

2005

Language:

english

File:

PDF, 692 KB

english, 2005

81

Diffusion in confinement: kinetic simulations of self- and collective diffusion behavior of adsorbed gases

Abouelnasr, Mahmoud K. F., Smit, Berend

Journal:

Physical Chemistry Chemical Physics

Year:

2012

Language:

english

File:

PDF, 3.06 MB

english, 2012

82

Comment on “Cluster Formation of Transmembrane Proteins Due to Hydrophobic Mismatching”

de Meyer, Frédérick, Smit, Berend

Journal:

Physical Review Letters

Year:

2009

Language:

english

File:

PDF, 72 KB

english, 2009

83

Similarity-Driven Discovery of Zeolite Materials for Adsorption-Based Separations

Dr. Richard L. Martin, Thomas F. Willems, Li-Chiang Lin, Dr. Jihan Kim, Joseph A. Swisher, Prof. Dr. Berend Smit, Dr. Maciej Haranczyk

Journal:

Year:

2012

Language:

english

File:

PDF, 2.00 MB

english, 2012

84

Hydroxycholesterols in serum from hypercholesterolaemic patients with and without bile acid sequestrant therapy

Jasper J. van Doormaal, Nienke Smit, Berend J. Koopman, Jan C. van Der Molen, Bert G. Wolthers, Hieronymus Doorenbos

Journal:

Clinica Chimica Acta

Year:

1989

Language:

english

File:

PDF, 513 KB

english, 1989

85

Simulating the effect of alcohol on the structure of a membrane

Marieke Kranenburg, Berend Smit

Journal:

Year:

2004

Language:

english

File:

PDF, 289 KB

english, 2004

86

CO 2 Capture by Metal–Organic Frameworks with van der Waals Density Functionals

Poloni, Roberta, Smit, Berend, Neaton, Jeffrey B.

Journal:

Journal of Physical Chemistry A

Year:

2012

Language:

english

File:

PDF, 1.96 MB

english, 2012

87

Computer Simulation of Incommensurate Diffusion in Zeolites: Understanding Window Effects

Dubbeldam, David, Smit, Berend

Journal:

Journal of Physical Chemistry B

Year:

2003

Language:

english

File:

PDF, 770 KB

english, 2003

88

Simulating the Effect of Nonframework Cations on the Adsorption of Alkanes in MFI-type Zeolites

Beerdsen, Edith, Dubbeldam, David, Smit, Berend, Vlugt, Thijs J. H., Calero, Sofía

Journal:

Journal of Physical Chemistry B

Year:

2003

Language:

english

File:

PDF, 611 KB

english, 2003

89

Understanding the Role of Sodium during Adsorption: A Force Field for Alkanes in Sodium-Exchanged Faujasites

Calero, Sofía, Dubbeldam, David, Krishna, Rajamani, Smit, Berend, Vlugt, Thijs J. H., Denayer, Joeri F. M., Martens, Johan A., Maesen, Theo L. M.

Journal:

Journal of the American Chemical Society

Year:

2004

Language:

english

File:

PDF, 708 KB

english, 2004

90

Simulating the Adsorption Isotherms of Methane, Ethane, and Propane in the Zeolite Silicalite

Journal:

Journal of Physical Chemistry

Year:

1995

Language:

english

File:

PDF, 808 KB

english, 1995

91

Evaluating mixture adsorption models using molecular simulation

Swisher, Joseph A., Lin, Li-Chiang, Kim, Jihan, Smit, Berend

Journal:

Year:

2013

Language:

english

File:

PDF, 1.78 MB

english, 2013

92

Cover Picture: Similarity-Driven Discovery of Zeolite Materials for Adsorption-Based Separations (ChemPhysChem 16/2012)

Martin, Richard L., Willems, Thomas F., Lin, Li-Chiang, Kim, Jihan, Swisher, Joseph A., Smit, Berend, Haranczyk, Maciej

Journal:

Year:

2012

File:

PDF, 734 KB

2012

93

Molecular Simulation of the Effect of Cholesterol on Lipid-Mediated Protein-Protein Interactions

de Meyer, Frédérick J.-M., Rodgers, Jocelyn M., Willems, Thomas F., Smit, Berend

Journal:

Biophysical Journal

Year:

2010

Language:

english

File:

PDF, 1.16 MB

english, 2010

94

Robust Driving Forces for Transmembrane Helix Packing

Benjamini, Ayelet, Smit, Berend

Journal:

Biophysical Journal

Year:

2012

Language:

english

File:

PDF, 794 KB

english, 2012

95

Simulating Induced Interdigitation in Membranes

Kranenburg, Marieke, Vlaar, Martin, Smit, Berend

Journal:

Biophysical Journal

Year:

2004

Language:

english

File:

PDF, 315 KB

english, 2004

96

Simulation Studies of Protein-Induced Bilayer Deformations, and Lipid-Induced Protein Tilting, on a Mesoscopic Model for Lipid Bilayers with Embedded Proteins

Venturoli, Maddalena, Smit, Berend, Sperotto, Maria Maddalena

Journal:

Biophysical Journal

Year:

2005

Language:

english

File:

PDF, 598 KB

english, 2005

97

Molecular Simulations of Lipid-Mediated Protein-Protein Interactions

de Meyer, Frédérick Jean-Marie, Venturoli, Maddalena, Smit, Berend

Journal:

Biophysical Journal

Year:

2008

Language:

english

File:

PDF, 1.63 MB

english, 2008

98

In silico screening of carbon-capture materials

Lin, Li-Chiang, Berger, Adam H., Martin, Richard L., Kim, Jihan, Swisher, Joseph A., Jariwala, Kuldeep, Rycroft, Chris H., Bhown, Abhoyjit S., Deem, Michael W., Haranczyk, Maciej, Smit, Berend

Journal:

Nature Materials

Year:

2012

Language:

english

File:

PDF, 1.38 MB

english, 2012

99

Diffusion of isobutane in silicalite studied by transition path sampling

Vlugt, Thijs J. H., Dellago, Christoph, Smit, Berend

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 644 KB

english, 2000

100

Comparative Molecular Simulation Study of CO 2 /N 2 and CH 4 /N 2 Separation in Zeolites and Metal−Organic Frameworks

Liu, Bei, Smit, Berend

Journal:

Year:

2009

Language:

english

File:

PDF, 2.16 MB

english, 2009