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1

MoSDeF, a Python Framework Enabling Large-Scale Computational Screening of Soft Matter: Application to Chemistry-Property Relationships in Lubricating Monolayer Films

Summers, Andrew Z., Gilmer, Justin B., Iacovella, Christopher R, Cummings, Peter T., McCabe, Clare

Journal:

Journal of Chemical Theory and Computation

Year:

2020

Language:

english

File:

PDF, 4.31 MB

english, 2020

2

Management Development Skills in the Hospitality and Tourism Sector: Needs and Issues from a Regional Perspective

Foster, Clare, McCabe, Scott, Dewhurst, Helen

Journal:

Tourism and Hospitality Planning & Development

Year:

2010

Language:

english

File:

PDF, 109 KB

english, 2010

3

The Role and Function of Narrative in Tourist Interaction

McCabe, Scott, Foster, Clare

Journal:

Journal of Tourism and Cultural Change

Year:

2006

Language:

english

File:

PDF, 316 KB

english, 2006

4

[IEEE 2019 Eleventh International Conference on Quality of Multimedia Experience (QoMEX) - Berlin, Germany (2019.6.5-2019.6.7)] 2019 Eleventh International Conference on Quality of Multimedia Experience (QoMEX) - The ALOS Dataset for Advert Localization in Outdoor Scenes

Dev, Soumyabrata, Hossari, Murhaf, Nicholson, Matthew, McCabe, Killian, Clare Conran, Atul Nautiyal, Tang, Jian, Xu, Wei, Pitie, Francois

Year:

2019

Language:

english

File:

PDF, 2.36 MB

english, 2019

5

Perfluoropolyethers: Development of an All-Atom Force Field for Molecular Simulations and Validation with New Experimental Vapor Pressures and Liquid Densities

Black, Jana E., Silva, Gonçalo M. C., Klein, Christoph, Iacovella, Christopher R., Morgado, Pedro, Martins, Luís F. G., Filipe, Eduardo J. M., McCabe, Clare

Journal:

Journal of Physical Chemistry B

Year:

2017

Language:

english

File:

PDF, 1.49 MB

english, 2017

6

Vapor-liquid equilibria for binary systems carbon dioxideÂ +Â 1,1,1,2,3,3-hexafluoro-3-(2,2,2-trifluoroethoxy)propane or 1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluorobutane at 303.15â323.15Â K

Matsuda, Hiroyuki, Suga, Toru, Tsuji, Tomoya, Tochigi, Katsumi, Kurihara, Kiyofumi, Nelson, Alyssa K., McCabe, Clare

Journal:

Fluid Phase Equilibria

Year:

2020

File:

PDF, 1.03 MB

2020

7

[IEEE 2019 16th International Conference on Machine Vision Applications (MVA) - Tokyo, Japan (2019.5.27-2019.5.31)] 2019 16th International Conference on Machine Vision Applications (MVA) - The CASE Dataset of Candidate Spaces for Advert Implantation

Dev, Soumyabrata, Hossari, Murhaf, Nicholson, Matthew, McCabe, Killian, Nautiyal, Atul, Conran, Clare, Tang, Jian, Xu, Wei, Pitie, Francois

Year:

2019

Language:

english

File:

PDF, 1.81 MB

english, 2019

8

Voice Outcomes After Transoral Laser Microsurgery for Early Glottic Cancer—Considering Signal Type and Smoothed Cepstral Peak Prominence

Stone, Danielle, McCabe, Patricia, Palme, Carsten E., Heard, Robert, Eastwood, Clare, Riffat, Faruque, Madill, Catherine

Journal:

Journal of Voice

Year:

2015

Language:

english

File:

PDF, 1.07 MB

english, 2015

9

Examination of the phase transition behavior of nano-confined fluids by statistical temperature molecular dynamics

Gai, Lili, Iacovella, Christopher R., Wan, Li, McCabe, Clare, Cummings, Peter T.

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 7.53 MB

english, 2015

10

Effect of Ceramide Tail Length on the Structure of Model Stratum Corneum Lipid Bilayers

Moore, Timothy C., Hartkamp, Remco, Iacovella, Christopher R., Bunge, Annette L., McCabe, Clare

Journal:

Biophysical Journal

Year:

2018

Language:

english

File:

PDF, 2.65 MB

english, 2018

11

Modelling the phase behaviour and excess properties of alkane + perfluoroalkane binary mixtures with the SAFT–VR approach

Pedro Morgado, Clare McCabe, Eduardo J. M. Filipe

Journal:

Fluid Phase Equilibria

Year:

2005

Language:

english

File:

PDF, 129 KB

english, 2005

12

Discriminating between Correlations of Experimental Viscosity Data for Perfluorobutane Using Molecular Simulation

McCabe, Clare, Bedrov, Dmitry, Smith, Grant D., Cummings, Peter T.

Journal:

Industrial & Engineering Chemistry Research

Year:

2001

Language:

english

File:

PDF, 31 KB

english, 2001

13

Liquid Phase Behavior of Perfluoroalkylalkane Surfactants

Morgado, Pedro, Zhao, Honggang, Blas, Felipe J., McCabe, Clare, Rebelo, Luís Paulo N., Filipe, Eduardo J. M.

Journal:

Journal of Physical Chemistry B

Year:

2007

Language:

english

File:

PDF, 93 KB

english, 2007

14

Predicting Mixture Phase Equilibria and Critical Behavior Using the SAFT-VRX Approach

Sun, Lixin, Zhao, Honggang, Kiselev, Sergei B., McCabe, Clare

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 227 KB

english, 2005

15

[IEEE 2019 IEEE 7th International Conference on Computer Science and Network Technology (ICCSNT) - Dalian, China (2019.10.19-2019.10.20)] 2019 IEEE 7th International Conference on Computer Science and Network Technology (ICCSNT) - Identifying Candidate Spaces for Advert Implantation

Dev, Soumyabrata, Pitie, Francois, Javidnia, Hossein, Hossari, Murhaf, Nicholson, Matthew, McCabe, Killian, Nautiyal, Atul, Conran, Clare, Tang, Jian, Xu, Wei

Year:

2019

File:

PDF, 4.91 MB

2019

16

Application of SAFT–VRX to binary phase behaviour: alkanes

Lixin Sun, Honggang Zhao, Sergei B. Kiselev, Clare McCabe

Journal:

Fluid Phase Equilibria

Year:

2005

Language:

english

File:

PDF, 158 KB

english, 2005

17

Calculation of Viscous EHL Traction for Squalane Using Molecular Simulation and Rheometry

Scott Bair, Clare McCabe, Peter T. Cummings

Journal:

Tribology Letters

Year:

2002

Language:

english

File:

PDF, 128 KB

english, 2002

18

Molecular Dynamics Study of the Behavior of Selected Nanoscale Building Blocks in a Gel-Phase Lipid Bilayer

Redmill, Patrick S., McCabe, Clare

Journal:

Journal of Physical Chemistry B

Year:

2010

Language:

english

File:

PDF, 4.70 MB

english, 2010

19

Thermodynamic properties of freely-jointed hard-sphere multi-Yukawa chain fluids: theory and simulation

Clare McCabe, Yurij V. Kalyuzhnyi, Peter T. Cummings

Journal:

Fluid Phase Equilibria

Year:

2002

Language:

english

File:

PDF, 105 KB

english, 2002

20

Clinical research nursing: A critical resource in the national research enterprise

Clare E. Hastings, Cheryl A. Fisher, Margaret A. McCabe

Journal:

Nursing Outlook

Year:

2012

Language:

english

File:

PDF, 390 KB

english, 2012

21

Thermodynamic and Transport Properties of Polyhedral Oligomeric Sislesquioxanes in Poly(dimethylsiloxane)

Striolo, Alberto, McCabe, Clare, Cummings, Peter T.

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 1.89 MB

english, 2005

22

Examining the Adsorption (Vapor−Liquid Equilibria) of Short-Chain Hydrocarbons in Low-Density Polyethylene with the SAFT-VR Approach

McCabe, Clare, Galindo, Amparo, García-Lisbona, M. Nieves, Jackson, George

Journal:

Industrial & Engineering Chemistry Research

Year:

2001

Language:

english

File:

PDF, 90 KB

english, 2001

23

Thermodynamics of Liquid (Xenon + Methane) Mixtures

Dias, Lino M. B., Filipe, Eduardo J. M., McCabe, Clare, Calado, Jorge C. G.

Journal:

Journal of Physical Chemistry B

Year:

2004

Language:

english

File:

PDF, 101 KB

english, 2004

24

Influence of Surface Morphology on the Shear-Induced Wear of Alkylsilane Monolayers: Molecular Dynamics Study

Summers, Andrew Z., Iacovella, Christopher R, Billingsley, Matthew R., Arnold, Steven T., Cummings, Peter T., McCabe, Clare

Journal:

Year:

2016

Language:

english

File:

PDF, 6.66 MB

english, 2016

25

Molecular dynamics simulations of stratum corneum lipid mixtures: A multiscale perspective

Moore, Timothy C., Iacovella, Christopher R., Leonhard, Anne, Bunge, Annette L., McCabe, Clare

Journal:

Biochemical and Biophysical Research Communications

Year:

2017

Language:

english

File:

PDF, 7.96 MB

english, 2017

26

Development and validation of a targeted gene sequencing panel for application to disparate cancers

McCabe, Mark J., Gauthier, Marie-Emilie A., Chan, Chia-Ling, Thompson, Tanya J., De Sousa, Sunita M.C., Puttick, Clare, Grady, John P., Gayevskiy, Velimir, Tao, Jiang, Ying, Kevin, Cipponi, Arcadi, De

Journal:

Scientific Reports

Year:

2019

Language:

english

File:

PDF, 3.00 MB

english, 2019

27

Fourier space approach to the classical density functional theory for multi-Yukawa and square-well fluids

Hlushak, Stepan P., McCabe, Clare, Cummings, Peter T.

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 1022 KB

english, 2012

28

On the liquid mixtures of xenon, alkanes and perfluorinated compounds

McCabe, Clare, Dias, Lino M. B., Jackson, George, Filipe, Eduardo J. M.

Journal:

Physical Chemistry Chemical Physics

Year:

2001

Language:

english

File:

PDF, 109 KB

english, 2001

29

Evaluation of Force Fields for Molecular Simulation of Polyhedral Oligomeric Silsesquioxanes

Ionescu, Tudor C., Qi, Feng, McCabe, Clare, Striolo, Alberto, Kieffer, John, Cummings, Peter T.

Journal:

Journal of Physical Chemistry B

Year:

2006

Language:

english

File:

PDF, 390 KB

english, 2006

30

Risk of subsequent primary neoplasms in survivors of adolescent and young adult cancer (Teenage and Young Adult Cancer Survivor Study): a population-based, cohort study

Bright, Chloe J, Reulen, Raoul C, Winter, David L, Stark, Daniel P, McCabe, Martin G, Edgar, Angela B, Frobisher, Clare, Hawkins, Michael M

Journal:

The Lancet Oncology

Year:

2019

Language:

english

File:

PDF, 260 KB

english, 2019

31

The O-Glycosylated Linker from the Trichoderma reesei Family 7 Cellulase Is a Flexible, Disordered Protein

Beckham, Gregg T., Bomble, Yannick J., Matthews, James F., Taylor, Courtney B., Resch, Michael G., Yarbrough, John M., Decker, Steve R., Bu, Lintao, Zhao, Xiongce, McCabe, Clare, Wohlert, Jakob, Berge

Journal:

Biophysical Journal

Year:

2010

Language:

english

File:

PDF, 473 KB

english, 2010

32

Molecular simulations of liquid-liquid interfacial properties: Water– n -alkane and water-methanol– n -alkane systems

Rivera, José L., McCabe, Clare, Cummings, Peter T.

Journal:

Physical Review E

Year:

2003

Language:

english

File:

PDF, 385 KB

english, 2003

33

Binding Site Dynamics and Aromatic–Carbohydrate Interactions in Processive and Non-Processive Family 7 Glycoside Hydrolases

Taylor, Courtney B., Payne, Christina M., Himmel, Michael E., Crowley, Michael F., McCabe, Clare, Beckham, Gregg T.

Journal:

Journal of Physical Chemistry B

Year:

2013

Language:

english

File:

PDF, 1.53 MB

english, 2013

34

Examining the rheology of 9-octylheptadecane to giga-pascal pressures

McCabe, Clare, Cui, Shengting, Cummings, Peter T., Gordon, Peter A., Saeger, Roland B.

Journal:

The Journal of Chemical Physics

Year:

2001

Language:

english

File:

PDF, 288 KB

english, 2001

35

Tunable transition from hydration to monomer-supported lubrication in zwitterionic monolayers revealed by molecular dynamics simulation

Klein, Christoph, Iacovella, Christopher R., McCabe, Clare, Cummings, Peter T.

Journal:

Year:

2015

Language:

english

File:

PDF, 1.62 MB

english, 2015

36

The Effectiveness of a Patient-Centred Assessment with a Solution-Focused Approach (DIALOG+) for Patients with Psychosis: A Pragmatic Cluster-Randomised Controlled Trial in Community Care

Priebe, Stefan, Kelley, Lauren, Omer, Serif, Golden, Eoin, Walsh, Sophie, Khanom, Husnara, Kingdon, David, Rutterford, Clare, McCrone, Paul, McCabe, Rosemarie

Journal:

Psychotherapy and Psychosomatics

Year:

2015

Language:

english

File:

PDF, 102 KB

english, 2015

37

On the thermodynamics of diblock chain fluids from simulation and heteronuclear statistical associating fluid theory for potentials of variable range

Peng, Yun, Zhao, Honggang, Mccabe, Clare

Journal:

Molecular Physics

Year:

2006

Language:

english

File:

PDF, 566 KB

english, 2006

38

How are nitrogen availability, fine‐root mass, and nitrogen uptake related empirically? Implications for models and theory

Dybzinski, Ray, Kelvakis, Angelo, McCabe, John, Panock, Samantha, Anuchitlertchon, Kanyarak, Vasarhelyi, Leah, Luke McCormack, M., McNickle, Gordon G., Poorter, Hendrik, Trinder, Clare, Farrior, Carol

Journal:

Global Change Biology

Year:

2018

Language:

english

File:

PDF, 2.04 MB

english, 2018

39

Examining Tail and Headgroup Effects on Binary and Ternary Gel-Phase Lipid Bilayer Structure

Yang, Alexander Hao, Moore, Timothy Craig, Iacovella, Christopher R, Thompson, Michael A., Moore, David J, McCabe, Clare

Journal:

Journal of Physical Chemistry B

Year:

2020

Language:

english

File:

PDF, 1.24 MB

english, 2020

40

Incorporating configurational-bias Monte Carlo into the Wang-Landau algorithm for continuous molecular systems

Maerzke, Katie A., Gai, Lili, Cummings, Peter T., McCabe, Clare

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 594 KB

english, 2012

41

Molecular Dynamics Study of Alkylsilane Monolayers on Realistic Amorphous Silica Surfaces

Black, Jana E., Iacovella, Christopher R., Cummings, Peter T., McCabe, Clare

Journal:

Year:

2015

Language:

english

File:

PDF, 3.62 MB

english, 2015

42

Call for papers - Special Issue Honoring Theo de Loos

Peters, Cor J., O'Connell, John P., McCabe, Clare

Journal:

Fluid Phase Equilibria

Year:

2016

Language:

english

File:

PDF, 112 KB

english, 2016

43

Frictional performance of silica microspheres

Steven G. Vilt, Nathaniel Martin, Clare McCabe, G. Kane Jennings

Journal:

Tribology International

Year:

2011

Language:

english

File:

PDF, 671 KB

english, 2011

44

Interactions of the complete cellobiohydrolase I fromTrichodera reeseiwith microcrystalline cellulose Iβ

Linghao Zhong, James F. Matthews, Michael F. Crowley, Tauna Rignall, César Talón, Joseph M. Cleary, Ross C. Walker, Giridhar Chukkapalli, Clare McCabe, Mark R. Nimlos, Charles L. Brooks, Michael E. Hi

Journal:

Year:

2008

Language:

english

File:

PDF, 559 KB

english, 2008

45

Stakeholder engagement in the design of scenarios of technology-enhanced tourism services

McCabe, Scott, Sharples, Mike, Foster, Clare

Journal:

Tourism Management Perspectives

Year:

2012

Language:

english

File:

PDF, 1.32 MB

english, 2012

46

Viscosity of Liquid Perfluoroalkanes and Perfluoroalkylalkane Surfactants

Morgado, Pedro, Laginhas, Carlos M. C., Lewis, J. Ben, McCabe, Clare, Martins, Luís F. G., Filipe, Eduardo J. M.

Journal:

Journal of Physical Chemistry B

Year:

2011

Language:

english

File:

PDF, 929 KB

english, 2011

47

Viscosity of liquid systems involving hydrogenated and fluorinated substances: Liquid mixtures of (hexane+perfluorohexane)

Morgado, Pedro, Black, Jana, Lewis, J. Ben, Iacovella, Christopher R., McCabe, Clare, Martins, Luís F.G., Filipe, Eduardo J.M.

Journal:

Fluid Phase Equilibria

Year:

2013

Language:

english

File:

PDF, 521 KB

english, 2013

48

Transport Properties of Perfluoroalkanes Using Molecular Dynamics Simulation: Comparison of United- and Explicit-Atom Models

McCabe, Clare, Bedrov, Dmitry, Borodin, Oleg, Smith, Grant D., Cummings, Peter T.

Journal:

Industrial & Engineering Chemistry Research

Year:

2003

Language:

english

File:

PDF, 70 KB

english, 2003

49

Transient time correlation function calculation of the viscosity of a molecular fluid at low shear rates: a comparison of stress tensors

Mazyar, Oleg A., Pan, Guoai, McCabe, Clare

Journal:

Molecular Physics

Year:

2009

Language:

english

File:

PDF, 447 KB

english, 2009

50

Liquid–vapour equilibrium of {xBF3 + (1 − x)n-butane} at 195.49 K

Lino M.B. Dias, Rui P. Bonifácio, Eduardo J.M. Filipe, Jorge C.G. Calado, Clare McCabe, George Jackson

Journal:

Fluid Phase Equilibria

Year:

2003

Language:

english

File:

PDF, 108 KB

english, 2003

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