Advanced search options

Advanced Search Options 🞨

Browse by author name (“Author name starts with…”).

Find ETDs with:

in
/  
in
/  
in
/  
in

Written in Published in Earliest date Latest date

Sorted by

Results per page:

Sorted by: relevance · author · university · dateNew search

You searched for subject:(MD simulation). Showing records 1 – 30 of 80 total matches.

[1] [2] [3]

Search Limiters

Last 2 Years | English Only

Degrees

Levels

▼ Search Limiters

1. Zhang, Baofeng. Molecular Dynamics Simulation and Theoretical Studies of Vibrational Energy Relaxation: Vibrational Energy Relaxation of a Large Polyatomic Molecule in a Liquid.

Degree: PhD, Chemistry, 2012, Brown University

 Our central goal in this thesis is to investigate the vibrational energy relaxation (VER) of perylene in solution. The size of a perylene molecule makes… (more)

Subjects/Keywords: MD simulation

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Zhang, B. (2012). Molecular Dynamics Simulation and Theoretical Studies of Vibrational Energy Relaxation: Vibrational Energy Relaxation of a Large Polyatomic Molecule in a Liquid. (Doctoral Dissertation). Brown University. Retrieved from https://repository.library.brown.edu/studio/item/bdr:297591/

Chicago Manual of Style (16th Edition):

Zhang, Baofeng. “Molecular Dynamics Simulation and Theoretical Studies of Vibrational Energy Relaxation: Vibrational Energy Relaxation of a Large Polyatomic Molecule in a Liquid.” 2012. Doctoral Dissertation, Brown University. Accessed April 12, 2021. https://repository.library.brown.edu/studio/item/bdr:297591/.

MLA Handbook (7th Edition):

Zhang, Baofeng. “Molecular Dynamics Simulation and Theoretical Studies of Vibrational Energy Relaxation: Vibrational Energy Relaxation of a Large Polyatomic Molecule in a Liquid.” 2012. Web. 12 Apr 2021.

Vancouver:

Zhang B. Molecular Dynamics Simulation and Theoretical Studies of Vibrational Energy Relaxation: Vibrational Energy Relaxation of a Large Polyatomic Molecule in a Liquid. [Internet] [Doctoral dissertation]. Brown University; 2012. [cited 2021 Apr 12]. Available from: https://repository.library.brown.edu/studio/item/bdr:297591/.

Council of Science Editors:

Zhang B. Molecular Dynamics Simulation and Theoretical Studies of Vibrational Energy Relaxation: Vibrational Energy Relaxation of a Large Polyatomic Molecule in a Liquid. [Doctoral Dissertation]. Brown University; 2012. Available from: https://repository.library.brown.edu/studio/item/bdr:297591/

2. Creazzo, Fabrizio. Oxygen evolution reaction at cobalt oxides/water interfaces : heterogeneous electrocatalysis by DFT-MD simulations & metadynamics : Réaction d'évolution de l'oxygène aux interfaces d'oxides de cobalt/eau liquide : électrocatalyse hétérogène par simulations de DFT-MD et de metadynamique.

Degree: Docteur es, Chimie, 2020, université Paris-Saclay

Dans cette thèse, des simulations DFT-MD couplées à des techniques inno-vantes de métadynamique, sont appliquées pour acquérir une compréhensionglobale des interfaces aqueuses d'oxyde de cobalt… (more)

Subjects/Keywords: Simulation DFT-MD; Métadynamique; DFT-MD; Metadynamics

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Creazzo, F. (2020). Oxygen evolution reaction at cobalt oxides/water interfaces : heterogeneous electrocatalysis by DFT-MD simulations & metadynamics : Réaction d'évolution de l'oxygène aux interfaces d'oxides de cobalt/eau liquide : électrocatalyse hétérogène par simulations de DFT-MD et de metadynamique. (Doctoral Dissertation). université Paris-Saclay. Retrieved from http://www.theses.fr/2020UPASE012

Chicago Manual of Style (16th Edition):

Creazzo, Fabrizio. “Oxygen evolution reaction at cobalt oxides/water interfaces : heterogeneous electrocatalysis by DFT-MD simulations & metadynamics : Réaction d'évolution de l'oxygène aux interfaces d'oxides de cobalt/eau liquide : électrocatalyse hétérogène par simulations de DFT-MD et de metadynamique.” 2020. Doctoral Dissertation, université Paris-Saclay. Accessed April 12, 2021. http://www.theses.fr/2020UPASE012.

MLA Handbook (7th Edition):

Creazzo, Fabrizio. “Oxygen evolution reaction at cobalt oxides/water interfaces : heterogeneous electrocatalysis by DFT-MD simulations & metadynamics : Réaction d'évolution de l'oxygène aux interfaces d'oxides de cobalt/eau liquide : électrocatalyse hétérogène par simulations de DFT-MD et de metadynamique.” 2020. Web. 12 Apr 2021.

Vancouver:

Creazzo F. Oxygen evolution reaction at cobalt oxides/water interfaces : heterogeneous electrocatalysis by DFT-MD simulations & metadynamics : Réaction d'évolution de l'oxygène aux interfaces d'oxides de cobalt/eau liquide : électrocatalyse hétérogène par simulations de DFT-MD et de metadynamique. [Internet] [Doctoral dissertation]. université Paris-Saclay; 2020. [cited 2021 Apr 12]. Available from: http://www.theses.fr/2020UPASE012.

Council of Science Editors:

Creazzo F. Oxygen evolution reaction at cobalt oxides/water interfaces : heterogeneous electrocatalysis by DFT-MD simulations & metadynamics : Réaction d'évolution de l'oxygène aux interfaces d'oxides de cobalt/eau liquide : électrocatalyse hétérogène par simulations de DFT-MD et de metadynamique. [Doctoral Dissertation]. université Paris-Saclay; 2020. Available from: http://www.theses.fr/2020UPASE012


Universiteit Utrecht

3. Wolterink, J.M. Extending Time Scales for Molecular Simulations.

Degree: 2012, Universiteit Utrecht

 Molecular dynamics simulations and protein structure prediction are essential tools in the quest for better understanding of the behavior of complex proteins. Based on these… (more)

Subjects/Keywords: ARPS; MD; GPU; Simulation

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Wolterink, J. M. (2012). Extending Time Scales for Molecular Simulations. (Masters Thesis). Universiteit Utrecht. Retrieved from http://dspace.library.uu.nl:8080/handle/1874/261054

Chicago Manual of Style (16th Edition):

Wolterink, J M. “Extending Time Scales for Molecular Simulations.” 2012. Masters Thesis, Universiteit Utrecht. Accessed April 12, 2021. http://dspace.library.uu.nl:8080/handle/1874/261054.

MLA Handbook (7th Edition):

Wolterink, J M. “Extending Time Scales for Molecular Simulations.” 2012. Web. 12 Apr 2021.

Vancouver:

Wolterink JM. Extending Time Scales for Molecular Simulations. [Internet] [Masters thesis]. Universiteit Utrecht; 2012. [cited 2021 Apr 12]. Available from: http://dspace.library.uu.nl:8080/handle/1874/261054.

Council of Science Editors:

Wolterink JM. Extending Time Scales for Molecular Simulations. [Masters Thesis]. Universiteit Utrecht; 2012. Available from: http://dspace.library.uu.nl:8080/handle/1874/261054


IUPUI

4. Leng, Xiaoling. Insights on PUFA-containing lipid membranes probed by MD simulations.

Degree: 2017, IUPUI

Indiana University-Purdue University Indianapolis (IUPUI)

The cell membrane serves as a barrier between the interior and exterior of a living cell. Its main structural component… (more)

Subjects/Keywords: PUFA; lipid membrane; MD simulation

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Leng, X. (2017). Insights on PUFA-containing lipid membranes probed by MD simulations. (Thesis). IUPUI. Retrieved from http://hdl.handle.net/1805/12326

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Leng, Xiaoling. “Insights on PUFA-containing lipid membranes probed by MD simulations.” 2017. Thesis, IUPUI. Accessed April 12, 2021. http://hdl.handle.net/1805/12326.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Leng, Xiaoling. “Insights on PUFA-containing lipid membranes probed by MD simulations.” 2017. Web. 12 Apr 2021.

Vancouver:

Leng X. Insights on PUFA-containing lipid membranes probed by MD simulations. [Internet] [Thesis]. IUPUI; 2017. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/1805/12326.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Leng X. Insights on PUFA-containing lipid membranes probed by MD simulations. [Thesis]. IUPUI; 2017. Available from: http://hdl.handle.net/1805/12326

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


Vanderbilt University

5. Zhang, Yu. Molecular Dynamics Study of Electric Double Layer Capacitors: Modifying Electrode and Electrolyte Composition.

Degree: PhD, Chemical Engineering, 2019, Vanderbilt University

 Electric double layer capacitors (EDLCs) are energy storage devices that are the subject of active research due to high power density, moderate energy density, broad… (more)

Subjects/Keywords: Supercapacitor; MD simulation; Ionic liquids; Carbon materials

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Zhang, Y. (2019). Molecular Dynamics Study of Electric Double Layer Capacitors: Modifying Electrode and Electrolyte Composition. (Doctoral Dissertation). Vanderbilt University. Retrieved from http://hdl.handle.net/1803/12289

Chicago Manual of Style (16th Edition):

Zhang, Yu. “Molecular Dynamics Study of Electric Double Layer Capacitors: Modifying Electrode and Electrolyte Composition.” 2019. Doctoral Dissertation, Vanderbilt University. Accessed April 12, 2021. http://hdl.handle.net/1803/12289.

MLA Handbook (7th Edition):

Zhang, Yu. “Molecular Dynamics Study of Electric Double Layer Capacitors: Modifying Electrode and Electrolyte Composition.” 2019. Web. 12 Apr 2021.

Vancouver:

Zhang Y. Molecular Dynamics Study of Electric Double Layer Capacitors: Modifying Electrode and Electrolyte Composition. [Internet] [Doctoral dissertation]. Vanderbilt University; 2019. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/1803/12289.

Council of Science Editors:

Zhang Y. Molecular Dynamics Study of Electric Double Layer Capacitors: Modifying Electrode and Electrolyte Composition. [Doctoral Dissertation]. Vanderbilt University; 2019. Available from: http://hdl.handle.net/1803/12289


University of Rochester

6. Zhang, Xiaoju. Computational studies of yeast protein translational components.

Degree: PhD, 2016, University of Rochester

 In the past decades, RNA has been discovered to have new functional roles, and it is no longer considered simply intermediate molecule between DNA and… (more)

Subjects/Keywords: Conservation; Inhibitory codon pair; MD simulation; tRNA modification; Yeast

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Zhang, X. (2016). Computational studies of yeast protein translational components. (Doctoral Dissertation). University of Rochester. Retrieved from http://hdl.handle.net/1802/30945

Chicago Manual of Style (16th Edition):

Zhang, Xiaoju. “Computational studies of yeast protein translational components.” 2016. Doctoral Dissertation, University of Rochester. Accessed April 12, 2021. http://hdl.handle.net/1802/30945.

MLA Handbook (7th Edition):

Zhang, Xiaoju. “Computational studies of yeast protein translational components.” 2016. Web. 12 Apr 2021.

Vancouver:

Zhang X. Computational studies of yeast protein translational components. [Internet] [Doctoral dissertation]. University of Rochester; 2016. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/1802/30945.

Council of Science Editors:

Zhang X. Computational studies of yeast protein translational components. [Doctoral Dissertation]. University of Rochester; 2016. Available from: http://hdl.handle.net/1802/30945


University of Alberta

7. Ni, Xiao. Molecular simulation of the wetting of selected solvents on sand and clay surfaces.

Degree: MS, Chemical and Materials Engineering, 2009, University of Alberta

 Molecular dynamics simulation and density functional theory were applied to calculate heats of immersion (ΔHimm) of n-heptane, toluene, pyridine and water on two model sand… (more)

Subjects/Keywords: Wetting; Clay; Heat of Immersion; Sand; Oil Sands; MD Simulation

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Ni, X. (2009). Molecular simulation of the wetting of selected solvents on sand and clay surfaces. (Masters Thesis). University of Alberta. Retrieved from https://era.library.ualberta.ca/files/nc580n98b

Chicago Manual of Style (16th Edition):

Ni, Xiao. “Molecular simulation of the wetting of selected solvents on sand and clay surfaces.” 2009. Masters Thesis, University of Alberta. Accessed April 12, 2021. https://era.library.ualberta.ca/files/nc580n98b.

MLA Handbook (7th Edition):

Ni, Xiao. “Molecular simulation of the wetting of selected solvents on sand and clay surfaces.” 2009. Web. 12 Apr 2021.

Vancouver:

Ni X. Molecular simulation of the wetting of selected solvents on sand and clay surfaces. [Internet] [Masters thesis]. University of Alberta; 2009. [cited 2021 Apr 12]. Available from: https://era.library.ualberta.ca/files/nc580n98b.

Council of Science Editors:

Ni X. Molecular simulation of the wetting of selected solvents on sand and clay surfaces. [Masters Thesis]. University of Alberta; 2009. Available from: https://era.library.ualberta.ca/files/nc580n98b


Loyola University Chicago

8. Gao, Yi. Investigation of Pharmaceutical Mass Transfer Phenomena Using Molecular Dynamics Simulations.

Degree: PhD, Chemistry, 2014, Loyola University Chicago

  Molecular dynamics (MD) simulation has been widely used in understanding the physical basis of the structure and function of biological macromolecules. However, its application… (more)

Subjects/Keywords: dissolution; interaction; MD simulation; Pharmaceutical; polymer; polymorph; Pharmacy and Pharmaceutical Sciences

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Gao, Y. (2014). Investigation of Pharmaceutical Mass Transfer Phenomena Using Molecular Dynamics Simulations. (Doctoral Dissertation). Loyola University Chicago. Retrieved from https://ecommons.luc.edu/luc_diss/1262

Chicago Manual of Style (16th Edition):

Gao, Yi. “Investigation of Pharmaceutical Mass Transfer Phenomena Using Molecular Dynamics Simulations.” 2014. Doctoral Dissertation, Loyola University Chicago. Accessed April 12, 2021. https://ecommons.luc.edu/luc_diss/1262.

MLA Handbook (7th Edition):

Gao, Yi. “Investigation of Pharmaceutical Mass Transfer Phenomena Using Molecular Dynamics Simulations.” 2014. Web. 12 Apr 2021.

Vancouver:

Gao Y. Investigation of Pharmaceutical Mass Transfer Phenomena Using Molecular Dynamics Simulations. [Internet] [Doctoral dissertation]. Loyola University Chicago; 2014. [cited 2021 Apr 12]. Available from: https://ecommons.luc.edu/luc_diss/1262.

Council of Science Editors:

Gao Y. Investigation of Pharmaceutical Mass Transfer Phenomena Using Molecular Dynamics Simulations. [Doctoral Dissertation]. Loyola University Chicago; 2014. Available from: https://ecommons.luc.edu/luc_diss/1262


Texas A&M University

9. Fu, Xuebing. How trehalose protects DNA in the dry state: a molecular dynamics simulation.

Degree: MS, Chemistry, 2008, Texas A&M University

 Molecular dynamics simulations were conducted on a system consisting of a decamer DNA solvated by trehalose and water (molecular ratio= 1:2), to mimic a relatively… (more)

Subjects/Keywords: trehalose; DNA; MD simulation

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Fu, X. (2008). How trehalose protects DNA in the dry state: a molecular dynamics simulation. (Masters Thesis). Texas A&M University. Retrieved from http://hdl.handle.net/1969.1/86002

Chicago Manual of Style (16th Edition):

Fu, Xuebing. “How trehalose protects DNA in the dry state: a molecular dynamics simulation.” 2008. Masters Thesis, Texas A&M University. Accessed April 12, 2021. http://hdl.handle.net/1969.1/86002.

MLA Handbook (7th Edition):

Fu, Xuebing. “How trehalose protects DNA in the dry state: a molecular dynamics simulation.” 2008. Web. 12 Apr 2021.

Vancouver:

Fu X. How trehalose protects DNA in the dry state: a molecular dynamics simulation. [Internet] [Masters thesis]. Texas A&M University; 2008. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/1969.1/86002.

Council of Science Editors:

Fu X. How trehalose protects DNA in the dry state: a molecular dynamics simulation. [Masters Thesis]. Texas A&M University; 2008. Available from: http://hdl.handle.net/1969.1/86002


Texas A&M University

10. Hu, Yuzhu. Numerical Investigation of the Effect of Chirality of Carbon Nanotube on the Interfacial Thermal Resistance.

Degree: MS, Mechanical Engineering, 2014, Texas A&M University

 Concentrated Solar Power (CSP) systems are used widely as a stable and reliable renewable source of energy. However, intermittency of this power source and the… (more)

Subjects/Keywords: Interfacial Thermal Resistance; Carbon Nanotube; MD simulation; Chirality

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Hu, Y. (2014). Numerical Investigation of the Effect of Chirality of Carbon Nanotube on the Interfacial Thermal Resistance. (Masters Thesis). Texas A&M University. Retrieved from http://hdl.handle.net/1969.1/153304

Chicago Manual of Style (16th Edition):

Hu, Yuzhu. “Numerical Investigation of the Effect of Chirality of Carbon Nanotube on the Interfacial Thermal Resistance.” 2014. Masters Thesis, Texas A&M University. Accessed April 12, 2021. http://hdl.handle.net/1969.1/153304.

MLA Handbook (7th Edition):

Hu, Yuzhu. “Numerical Investigation of the Effect of Chirality of Carbon Nanotube on the Interfacial Thermal Resistance.” 2014. Web. 12 Apr 2021.

Vancouver:

Hu Y. Numerical Investigation of the Effect of Chirality of Carbon Nanotube on the Interfacial Thermal Resistance. [Internet] [Masters thesis]. Texas A&M University; 2014. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/1969.1/153304.

Council of Science Editors:

Hu Y. Numerical Investigation of the Effect of Chirality of Carbon Nanotube on the Interfacial Thermal Resistance. [Masters Thesis]. Texas A&M University; 2014. Available from: http://hdl.handle.net/1969.1/153304


Penn State University

11. Qi, Xin. Probing monocrystalline and multiply-twinned nanocrystal growth from thermodynamic and kinetic perspectives.

Degree: 2018, Penn State University

 Metal nanocrystals are beautiful and powerful. While they attract great attentions for their exceptional structural-dependent performance in an array of modern technologies, how they are… (more)

Subjects/Keywords: Ag; nanocrystal growth; MD simulation; Theory; thermodynamics; kinetics

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Qi, X. (2018). Probing monocrystalline and multiply-twinned nanocrystal growth from thermodynamic and kinetic perspectives. (Thesis). Penn State University. Retrieved from https://submit-etda.libraries.psu.edu/catalog/15413xzq103

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Qi, Xin. “Probing monocrystalline and multiply-twinned nanocrystal growth from thermodynamic and kinetic perspectives.” 2018. Thesis, Penn State University. Accessed April 12, 2021. https://submit-etda.libraries.psu.edu/catalog/15413xzq103.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Qi, Xin. “Probing monocrystalline and multiply-twinned nanocrystal growth from thermodynamic and kinetic perspectives.” 2018. Web. 12 Apr 2021.

Vancouver:

Qi X. Probing monocrystalline and multiply-twinned nanocrystal growth from thermodynamic and kinetic perspectives. [Internet] [Thesis]. Penn State University; 2018. [cited 2021 Apr 12]. Available from: https://submit-etda.libraries.psu.edu/catalog/15413xzq103.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Qi X. Probing monocrystalline and multiply-twinned nanocrystal growth from thermodynamic and kinetic perspectives. [Thesis]. Penn State University; 2018. Available from: https://submit-etda.libraries.psu.edu/catalog/15413xzq103

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


Penn State University

12. Jo, Gunwoo. PROTON HOPPING IN A SINGLE LAYER WATER BETWEEN MXENE LAYERS USING REAXFF MD SIMULATION.

Degree: 2017, Penn State University

 The purpose of this thesis is to analyze proton migrations in single layer water which is located between two MXene layers with nine different temperatures… (more)

Subjects/Keywords: MXenes; ReaxFF; Proton hopping; Diffusion constant; MD simulation

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Jo, G. (2017). PROTON HOPPING IN A SINGLE LAYER WATER BETWEEN MXENE LAYERS USING REAXFF MD SIMULATION. (Thesis). Penn State University. Retrieved from https://submit-etda.libraries.psu.edu/catalog/13879gzj5062

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Jo, Gunwoo. “PROTON HOPPING IN A SINGLE LAYER WATER BETWEEN MXENE LAYERS USING REAXFF MD SIMULATION.” 2017. Thesis, Penn State University. Accessed April 12, 2021. https://submit-etda.libraries.psu.edu/catalog/13879gzj5062.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Jo, Gunwoo. “PROTON HOPPING IN A SINGLE LAYER WATER BETWEEN MXENE LAYERS USING REAXFF MD SIMULATION.” 2017. Web. 12 Apr 2021.

Vancouver:

Jo G. PROTON HOPPING IN A SINGLE LAYER WATER BETWEEN MXENE LAYERS USING REAXFF MD SIMULATION. [Internet] [Thesis]. Penn State University; 2017. [cited 2021 Apr 12]. Available from: https://submit-etda.libraries.psu.edu/catalog/13879gzj5062.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Jo G. PROTON HOPPING IN A SINGLE LAYER WATER BETWEEN MXENE LAYERS USING REAXFF MD SIMULATION. [Thesis]. Penn State University; 2017. Available from: https://submit-etda.libraries.psu.edu/catalog/13879gzj5062

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

13. Mostofian, Barmak. The Dissolution of Cellulose in Ionic Liquids - A Molecular Dynamics Study.

Degree: 2014, University of Tennessee – Knoxville

 The use of ionic liquids for the dissolution of cellulose promises an alternative method for the thermochemical pretreatment of biomass that may be more efficient… (more)

Subjects/Keywords: Biofuels; Cellulose; Ionic Liquids; Pretreatment; MD Simulation; Biophysics

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Mostofian, B. (2014). The Dissolution of Cellulose in Ionic Liquids - A Molecular Dynamics Study. (Doctoral Dissertation). University of Tennessee – Knoxville. Retrieved from https://trace.tennessee.edu/utk_graddiss/3156

Chicago Manual of Style (16th Edition):

Mostofian, Barmak. “The Dissolution of Cellulose in Ionic Liquids - A Molecular Dynamics Study.” 2014. Doctoral Dissertation, University of Tennessee – Knoxville. Accessed April 12, 2021. https://trace.tennessee.edu/utk_graddiss/3156.

MLA Handbook (7th Edition):

Mostofian, Barmak. “The Dissolution of Cellulose in Ionic Liquids - A Molecular Dynamics Study.” 2014. Web. 12 Apr 2021.

Vancouver:

Mostofian B. The Dissolution of Cellulose in Ionic Liquids - A Molecular Dynamics Study. [Internet] [Doctoral dissertation]. University of Tennessee – Knoxville; 2014. [cited 2021 Apr 12]. Available from: https://trace.tennessee.edu/utk_graddiss/3156.

Council of Science Editors:

Mostofian B. The Dissolution of Cellulose in Ionic Liquids - A Molecular Dynamics Study. [Doctoral Dissertation]. University of Tennessee – Knoxville; 2014. Available from: https://trace.tennessee.edu/utk_graddiss/3156


Clemson University

14. Senanayake, Manjula. Solvent as a Tool to Tune the Association of Structured Ionic Block Co-Polymers: Neutron Scattering and Computational Study.

Degree: PhD, Chemistry, 2020, Clemson University

  The work probes the behavior of associating polymers including their assembly in different environments, using neutron scattering techniques coupled with molecular dynamics (MD) simulations.… (more)

Subjects/Keywords: MD simulation; neutron scattering; polymers; soft matter; synthesis

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Senanayake, M. (2020). Solvent as a Tool to Tune the Association of Structured Ionic Block Co-Polymers: Neutron Scattering and Computational Study. (Doctoral Dissertation). Clemson University. Retrieved from https://tigerprints.clemson.edu/all_dissertations/2739

Chicago Manual of Style (16th Edition):

Senanayake, Manjula. “Solvent as a Tool to Tune the Association of Structured Ionic Block Co-Polymers: Neutron Scattering and Computational Study.” 2020. Doctoral Dissertation, Clemson University. Accessed April 12, 2021. https://tigerprints.clemson.edu/all_dissertations/2739.

MLA Handbook (7th Edition):

Senanayake, Manjula. “Solvent as a Tool to Tune the Association of Structured Ionic Block Co-Polymers: Neutron Scattering and Computational Study.” 2020. Web. 12 Apr 2021.

Vancouver:

Senanayake M. Solvent as a Tool to Tune the Association of Structured Ionic Block Co-Polymers: Neutron Scattering and Computational Study. [Internet] [Doctoral dissertation]. Clemson University; 2020. [cited 2021 Apr 12]. Available from: https://tigerprints.clemson.edu/all_dissertations/2739.

Council of Science Editors:

Senanayake M. Solvent as a Tool to Tune the Association of Structured Ionic Block Co-Polymers: Neutron Scattering and Computational Study. [Doctoral Dissertation]. Clemson University; 2020. Available from: https://tigerprints.clemson.edu/all_dissertations/2739

15. Schmelter, Ralf. Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran.

Degree: 2002, Universität Dortmund

 Phospholipide sind einer der Hauptbestandteile biologischer Membranen,welche neben der Kompartimentierung der Zellen für die Kontrolle vonStoffaustauschvorgängen verantwortlich sind. Weiterhin finden vielebedeutende biochemische Reaktionen in der… (more)

Subjects/Keywords: DPPC Phospholipid; MD-Simulation; Membran; 540

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Schmelter, R. (2002). Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran. (Thesis). Universität Dortmund. Retrieved from http://hdl.handle.net/2003/2514

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Schmelter, Ralf. “Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran.” 2002. Thesis, Universität Dortmund. Accessed April 12, 2021. http://hdl.handle.net/2003/2514.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Schmelter, Ralf. “Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran.” 2002. Web. 12 Apr 2021.

Vancouver:

Schmelter R. Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran. [Internet] [Thesis]. Universität Dortmund; 2002. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/2003/2514.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Schmelter R. Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran. [Thesis]. Universität Dortmund; 2002. Available from: http://hdl.handle.net/2003/2514

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

16. Schmelter, Ralf. Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran.

Degree: 2002, Technische Universität Dortmund

 Phospholipide sind einer der Hauptbestandteile biologischer Membranen,welche neben der Kompartimentierung der Zellen für die Kontrolle vonStoffaustauschvorgängen verantwortlich sind. Weiterhin finden vielebedeutende biochemische Reaktionen in der… (more)

Subjects/Keywords: MD-Simulation; Membran; DPPC Phospholipid; 540

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Schmelter, R. (2002). Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran. (Doctoral Dissertation). Technische Universität Dortmund. Retrieved from http://dx.doi.org/10.17877/DE290R-12161

Chicago Manual of Style (16th Edition):

Schmelter, Ralf. “Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran.” 2002. Doctoral Dissertation, Technische Universität Dortmund. Accessed April 12, 2021. http://dx.doi.org/10.17877/DE290R-12161.

MLA Handbook (7th Edition):

Schmelter, Ralf. “Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran.” 2002. Web. 12 Apr 2021.

Vancouver:

Schmelter R. Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran. [Internet] [Doctoral dissertation]. Technische Universität Dortmund; 2002. [cited 2021 Apr 12]. Available from: http://dx.doi.org/10.17877/DE290R-12161.

Council of Science Editors:

Schmelter R. Molekulardynamische Simulation einer voll hydratisierten Dipalmitoyl-glycero-phosphatidylcholin-Membran. [Doctoral Dissertation]. Technische Universität Dortmund; 2002. Available from: http://dx.doi.org/10.17877/DE290R-12161


University of Adelaide

17. Ayub, Md. Experimental and numerical investigation of a carbon nanotube acoustic absorber.

Degree: 2016, University of Adelaide

 The interest in applications of nanomaterials for acoustic absorption purposes is growing rapidly with advances in nanotechnology. A need also exists for a simulation framework… (more)

Subjects/Keywords: carbon nanotube; molecular dynamics (MD) simulation; acoustic absorber; exergy concepts; high frequency sound

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Ayub, M. (2016). Experimental and numerical investigation of a carbon nanotube acoustic absorber. (Thesis). University of Adelaide. Retrieved from http://hdl.handle.net/2440/112038

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Ayub, Md. “Experimental and numerical investigation of a carbon nanotube acoustic absorber.” 2016. Thesis, University of Adelaide. Accessed April 12, 2021. http://hdl.handle.net/2440/112038.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Ayub, Md. “Experimental and numerical investigation of a carbon nanotube acoustic absorber.” 2016. Web. 12 Apr 2021.

Vancouver:

Ayub M. Experimental and numerical investigation of a carbon nanotube acoustic absorber. [Internet] [Thesis]. University of Adelaide; 2016. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/2440/112038.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Ayub M. Experimental and numerical investigation of a carbon nanotube acoustic absorber. [Thesis]. University of Adelaide; 2016. Available from: http://hdl.handle.net/2440/112038

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

18. Ndumbe Ngale, Kenneth. Towards More Efficient Enhanced Sampling Methods To Study Phase Transitions.

Degree: PhD, Chemistry, 2013, University of North Dakota

  The most familiar phase transitions observed in nature are associated with a change in the state of matter (solid, liquid, and gas). In some… (more)

Subjects/Keywords: Critical properties; Crystallization; Molecular Dynamics (MD); Monte Carlo (MC); Phase Change; Simulation

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Ndumbe Ngale, K. (2013). Towards More Efficient Enhanced Sampling Methods To Study Phase Transitions. (Doctoral Dissertation). University of North Dakota. Retrieved from https://commons.und.edu/theses/1460

Chicago Manual of Style (16th Edition):

Ndumbe Ngale, Kenneth. “Towards More Efficient Enhanced Sampling Methods To Study Phase Transitions.” 2013. Doctoral Dissertation, University of North Dakota. Accessed April 12, 2021. https://commons.und.edu/theses/1460.

MLA Handbook (7th Edition):

Ndumbe Ngale, Kenneth. “Towards More Efficient Enhanced Sampling Methods To Study Phase Transitions.” 2013. Web. 12 Apr 2021.

Vancouver:

Ndumbe Ngale K. Towards More Efficient Enhanced Sampling Methods To Study Phase Transitions. [Internet] [Doctoral dissertation]. University of North Dakota; 2013. [cited 2021 Apr 12]. Available from: https://commons.und.edu/theses/1460.

Council of Science Editors:

Ndumbe Ngale K. Towards More Efficient Enhanced Sampling Methods To Study Phase Transitions. [Doctoral Dissertation]. University of North Dakota; 2013. Available from: https://commons.und.edu/theses/1460


University of Edinburgh

19. Patrick, Lisa. Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation.

Degree: PhD, 2020, University of Edinburgh

 Allosteric signalling was first discovered over 50 years ago, yet the underlying molecular determinants are not yet completely understood. The ability to predict the activity… (more)

Subjects/Keywords: protein simulations; allostery; Molecular Dynamics simulations; MD simulation; Mutual Information; Kullback-Leibler divergence

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Patrick, L. (2020). Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation. (Doctoral Dissertation). University of Edinburgh. Retrieved from http://hdl.handle.net/1842/37111

Chicago Manual of Style (16th Edition):

Patrick, Lisa. “Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation.” 2020. Doctoral Dissertation, University of Edinburgh. Accessed April 12, 2021. http://hdl.handle.net/1842/37111.

MLA Handbook (7th Edition):

Patrick, Lisa. “Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation.” 2020. Web. 12 Apr 2021.

Vancouver:

Patrick L. Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation. [Internet] [Doctoral dissertation]. University of Edinburgh; 2020. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/1842/37111.

Council of Science Editors:

Patrick L. Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation. [Doctoral Dissertation]. University of Edinburgh; 2020. Available from: http://hdl.handle.net/1842/37111


University of Edinburgh

20. Patrick, Lisa. Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation.

Degree: PhD, 2020, University of Edinburgh

 Allosteric signalling was first discovered over 50 years ago, yet the underlying molecular determinants are not yet completely understood. The ability to predict the activity… (more)

Subjects/Keywords: protein simulations; allostery; Molecular Dynamics simulations; MD simulation; Mutual Information; Kullback-Leibler divergence

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Patrick, L. (2020). Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation. (Doctoral Dissertation). University of Edinburgh. Retrieved from https://doi.org/10.7488/era/412 ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.806132

Chicago Manual of Style (16th Edition):

Patrick, Lisa. “Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation.” 2020. Doctoral Dissertation, University of Edinburgh. Accessed April 12, 2021. https://doi.org/10.7488/era/412 ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.806132.

MLA Handbook (7th Edition):

Patrick, Lisa. “Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation.” 2020. Web. 12 Apr 2021.

Vancouver:

Patrick L. Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation. [Internet] [Doctoral dissertation]. University of Edinburgh; 2020. [cited 2021 Apr 12]. Available from: https://doi.org/10.7488/era/412 ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.806132.

Council of Science Editors:

Patrick L. Development of an information theory based computational framework for the analysis of molecular dynamics simulations of proteins under allosteric regulation. [Doctoral Dissertation]. University of Edinburgh; 2020. Available from: https://doi.org/10.7488/era/412 ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.806132


University of Akron

21. Tian, Yuan, TIAN. How to Measure Work of Adhesion and Surface Tension of Soft Materials.

Degree: MS, Polymer Science, 2018, University of Akron

 Knowledge of the work of adhesion and surface tension plays an important role in the design of new materials for applications such as coatings, adhesives,… (more)

Subjects/Keywords: Physics; Polymers; Materials Science; work of adhesion; surface tension; MD simulation; networks; soft materials

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Tian, Yuan, T. (2018). How to Measure Work of Adhesion and Surface Tension of Soft Materials. (Masters Thesis). University of Akron. Retrieved from http://rave.ohiolink.edu/etdc/view?acc_num=akron1523295919890025

Chicago Manual of Style (16th Edition):

Tian, Yuan, TIAN. “How to Measure Work of Adhesion and Surface Tension of Soft Materials.” 2018. Masters Thesis, University of Akron. Accessed April 12, 2021. http://rave.ohiolink.edu/etdc/view?acc_num=akron1523295919890025.

MLA Handbook (7th Edition):

Tian, Yuan, TIAN. “How to Measure Work of Adhesion and Surface Tension of Soft Materials.” 2018. Web. 12 Apr 2021.

Vancouver:

Tian, Yuan T. How to Measure Work of Adhesion and Surface Tension of Soft Materials. [Internet] [Masters thesis]. University of Akron; 2018. [cited 2021 Apr 12]. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=akron1523295919890025.

Council of Science Editors:

Tian, Yuan T. How to Measure Work of Adhesion and Surface Tension of Soft Materials. [Masters Thesis]. University of Akron; 2018. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=akron1523295919890025


Swedish University of Agricultural Sciences

22. Eklund, Lars. Hydration of oxo anions.

Degree: 2014, Swedish University of Agricultural Sciences

 The structure and dynamics of several hydrated oxo anions were studied using multiple methodologies. Aqueous solutions of sulfate, sulfite, thiosulfate, peroxysulfate, selenite, selenate, hypochlorite, chlorite,… (more)

Subjects/Keywords: hydration; solutions; chemicophysical properties; simulation; models; hydration; oxoanion; coordination; QMCF/MD; LAXS; EXSAFS; DDIR; simulation; XANES

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Eklund, L. (2014). Hydration of oxo anions. (Doctoral Dissertation). Swedish University of Agricultural Sciences. Retrieved from http://pub.epsilon.slu.se/11192/

Chicago Manual of Style (16th Edition):

Eklund, Lars. “Hydration of oxo anions.” 2014. Doctoral Dissertation, Swedish University of Agricultural Sciences. Accessed April 12, 2021. http://pub.epsilon.slu.se/11192/.

MLA Handbook (7th Edition):

Eklund, Lars. “Hydration of oxo anions.” 2014. Web. 12 Apr 2021.

Vancouver:

Eklund L. Hydration of oxo anions. [Internet] [Doctoral dissertation]. Swedish University of Agricultural Sciences; 2014. [cited 2021 Apr 12]. Available from: http://pub.epsilon.slu.se/11192/.

Council of Science Editors:

Eklund L. Hydration of oxo anions. [Doctoral Dissertation]. Swedish University of Agricultural Sciences; 2014. Available from: http://pub.epsilon.slu.se/11192/


University of Illinois – Urbana-Champaign

23. Yu, Hang. Computational investigations of protein dynamics and its implication in cellular functions: two cases on membrane sculpting by protein complexes and molecular origin of Parkinson's disease.

Degree: PhD, Biophysics & Computional Biology, 2015, University of Illinois – Urbana-Champaign

 Proteins are complex machineries dedicated to drive many functions in eukaryotic cells. In this article, two cases of protein dynamics and their implications to cellular… (more)

Subjects/Keywords: Molecular dynamics simulation; molecular dynamics (MD) simulation; Protein; Membrane; Curvature; F-BAR domain; Parkinson’s disease; α-synuclein; β-hairpin

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Yu, H. (2015). Computational investigations of protein dynamics and its implication in cellular functions: two cases on membrane sculpting by protein complexes and molecular origin of Parkinson's disease. (Doctoral Dissertation). University of Illinois – Urbana-Champaign. Retrieved from http://hdl.handle.net/2142/89115

Chicago Manual of Style (16th Edition):

Yu, Hang. “Computational investigations of protein dynamics and its implication in cellular functions: two cases on membrane sculpting by protein complexes and molecular origin of Parkinson's disease.” 2015. Doctoral Dissertation, University of Illinois – Urbana-Champaign. Accessed April 12, 2021. http://hdl.handle.net/2142/89115.

MLA Handbook (7th Edition):

Yu, Hang. “Computational investigations of protein dynamics and its implication in cellular functions: two cases on membrane sculpting by protein complexes and molecular origin of Parkinson's disease.” 2015. Web. 12 Apr 2021.

Vancouver:

Yu H. Computational investigations of protein dynamics and its implication in cellular functions: two cases on membrane sculpting by protein complexes and molecular origin of Parkinson's disease. [Internet] [Doctoral dissertation]. University of Illinois – Urbana-Champaign; 2015. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/2142/89115.

Council of Science Editors:

Yu H. Computational investigations of protein dynamics and its implication in cellular functions: two cases on membrane sculpting by protein complexes and molecular origin of Parkinson's disease. [Doctoral Dissertation]. University of Illinois – Urbana-Champaign; 2015. Available from: http://hdl.handle.net/2142/89115


Université Montpellier II

24. Gołębiowska, Monika R. Mechanism of self-assembly and adsorption of molecules on surfaces : multiscale computer modeling : Mécanisme d'auto-assemblage et l'adsorption de molécules sur des surfaces : modélisation informatique multi-échelles.

Degree: Docteur es, Milieux denses et matériaux, 2011, Université Montpellier II

Le mémoire est consacré à l'étude numérique des phénomènes survenant à l'interface solide-fluide. Trois processus ont été étudiés: auto-organisation de films moléculaires sur un substrat… (more)

Subjects/Keywords: Simulations numeriques MC; Md; Adsorption; Transitions de phase; Stockage des gaz; Simulation de biomolecules; Computer simulations MC; Md; Adsorption; Phase transitions; Gas storage; BioSimulation de biommolecules simulations

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Gołębiowska, M. R. (2011). Mechanism of self-assembly and adsorption of molecules on surfaces : multiscale computer modeling : Mécanisme d'auto-assemblage et l'adsorption de molécules sur des surfaces : modélisation informatique multi-échelles. (Doctoral Dissertation). Université Montpellier II. Retrieved from http://www.theses.fr/2011MON20012

Chicago Manual of Style (16th Edition):

Gołębiowska, Monika R. “Mechanism of self-assembly and adsorption of molecules on surfaces : multiscale computer modeling : Mécanisme d'auto-assemblage et l'adsorption de molécules sur des surfaces : modélisation informatique multi-échelles.” 2011. Doctoral Dissertation, Université Montpellier II. Accessed April 12, 2021. http://www.theses.fr/2011MON20012.

MLA Handbook (7th Edition):

Gołębiowska, Monika R. “Mechanism of self-assembly and adsorption of molecules on surfaces : multiscale computer modeling : Mécanisme d'auto-assemblage et l'adsorption de molécules sur des surfaces : modélisation informatique multi-échelles.” 2011. Web. 12 Apr 2021.

Vancouver:

Gołębiowska MR. Mechanism of self-assembly and adsorption of molecules on surfaces : multiscale computer modeling : Mécanisme d'auto-assemblage et l'adsorption de molécules sur des surfaces : modélisation informatique multi-échelles. [Internet] [Doctoral dissertation]. Université Montpellier II; 2011. [cited 2021 Apr 12]. Available from: http://www.theses.fr/2011MON20012.

Council of Science Editors:

Gołębiowska MR. Mechanism of self-assembly and adsorption of molecules on surfaces : multiscale computer modeling : Mécanisme d'auto-assemblage et l'adsorption de molécules sur des surfaces : modélisation informatique multi-échelles. [Doctoral Dissertation]. Université Montpellier II; 2011. Available from: http://www.theses.fr/2011MON20012

25. 中村, 大城. データマイニングによる塩水濃度と水溶液の動的構造の関連性に関する研究.

Degree: Japan Advanced Institute of Science and Technology / 北陸先端科学技術大学院大学

Supervisor:DAM HIEU CHI 准教授

知識科学研究科

修士

Subjects/Keywords: data mining; MD simulation; 塩水; water behavior

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

中村, . (n.d.). データマイニングによる塩水濃度と水溶液の動的構造の関連性に関する研究. (Thesis). Japan Advanced Institute of Science and Technology / 北陸先端科学技術大学院大学. Retrieved from http://hdl.handle.net/10119/10470

Note: this citation may be lacking information needed for this citation format:
No year of publication.
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

中村, 大城. “データマイニングによる塩水濃度と水溶液の動的構造の関連性に関する研究.” Thesis, Japan Advanced Institute of Science and Technology / 北陸先端科学技術大学院大学. Accessed April 12, 2021. http://hdl.handle.net/10119/10470.

Note: this citation may be lacking information needed for this citation format:
No year of publication.
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

中村, 大城. “データマイニングによる塩水濃度と水溶液の動的構造の関連性に関する研究.” Web. 12 Apr 2021.

Note: this citation may be lacking information needed for this citation format:
No year of publication.

Vancouver:

中村 . データマイニングによる塩水濃度と水溶液の動的構造の関連性に関する研究. [Internet] [Thesis]. Japan Advanced Institute of Science and Technology / 北陸先端科学技術大学院大学; [cited 2021 Apr 12]. Available from: http://hdl.handle.net/10119/10470.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation
No year of publication.

Council of Science Editors:

中村 . データマイニングによる塩水濃度と水溶液の動的構造の関連性に関する研究. [Thesis]. Japan Advanced Institute of Science and Technology / 北陸先端科学技術大学院大学; Available from: http://hdl.handle.net/10119/10470

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation
No year of publication.


Baylor University

26. Ashtekar, Nikhil A. Non-deterministic modeling of the bulk thermal and electrical conductivity for dense thin film carbon nanotube networks.

Degree: M.S.M.E., Engineering., 2011, Baylor University

 Thin films composed of single-walled carbon nanotubes, enjoy very high thermal and electrical conductivities, well beyond that of polymer matrix composites, and are very light… (more)

Subjects/Keywords: Carbon nanotubes.; CNT thin films.; Buckypapers.; Thermal conductivity.; Electrical conductivity.; Mathematical modeling and MD simulation.; Sensitivity analysis.

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Ashtekar, N. A. (2011). Non-deterministic modeling of the bulk thermal and electrical conductivity for dense thin film carbon nanotube networks. (Masters Thesis). Baylor University. Retrieved from http://hdl.handle.net/2104/8113

Chicago Manual of Style (16th Edition):

Ashtekar, Nikhil A. “Non-deterministic modeling of the bulk thermal and electrical conductivity for dense thin film carbon nanotube networks.” 2011. Masters Thesis, Baylor University. Accessed April 12, 2021. http://hdl.handle.net/2104/8113.

MLA Handbook (7th Edition):

Ashtekar, Nikhil A. “Non-deterministic modeling of the bulk thermal and electrical conductivity for dense thin film carbon nanotube networks.” 2011. Web. 12 Apr 2021.

Vancouver:

Ashtekar NA. Non-deterministic modeling of the bulk thermal and electrical conductivity for dense thin film carbon nanotube networks. [Internet] [Masters thesis]. Baylor University; 2011. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/2104/8113.

Council of Science Editors:

Ashtekar NA. Non-deterministic modeling of the bulk thermal and electrical conductivity for dense thin film carbon nanotube networks. [Masters Thesis]. Baylor University; 2011. Available from: http://hdl.handle.net/2104/8113


Uppsala University

27. André, Tomas. Benchmarking Physical Properties of Water Models.

Degree: Molecular and Condensed Matter Physics, 2019, Uppsala University

    Water is a fundamental part of life as we know it, and by that also a fundamental for biology, chemistry, and parts of… (more)

Subjects/Keywords: Water Models; Molecular Dynamics; Properties of water; MD; Simulation; GROMACS; Atom and Molecular Physics and Optics; Atom- och molekylfysik och optik

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

André, T. (2019). Benchmarking Physical Properties of Water Models. (Thesis). Uppsala University. Retrieved from http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-388336

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

André, Tomas. “Benchmarking Physical Properties of Water Models.” 2019. Thesis, Uppsala University. Accessed April 12, 2021. http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-388336.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

André, Tomas. “Benchmarking Physical Properties of Water Models.” 2019. Web. 12 Apr 2021.

Vancouver:

André T. Benchmarking Physical Properties of Water Models. [Internet] [Thesis]. Uppsala University; 2019. [cited 2021 Apr 12]. Available from: http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-388336.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

André T. Benchmarking Physical Properties of Water Models. [Thesis]. Uppsala University; 2019. Available from: http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-388336

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


Oklahoma State University

28. Abdul Samadh, Abdul Nizam. Molecular Dynamics (MD) Simulations of Chemical Vapor Deposition (CVD) of Carbon Dimer on a Diamond (100) Surface and Application of Neural Networks (NN) for Event Probability Predictions.

Degree: Mechanical & Aerospace Engineering, 2005, Oklahoma State University

 Carbon dimers are found to be an important growth species in the growth of nanocrystalline diamond (NCD) through CVD process. Events, such as chemisorption, reflection,… (more)

Subjects/Keywords: md simulation; neural network; cvd; carbon dimer

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Abdul Samadh, A. N. (2005). Molecular Dynamics (MD) Simulations of Chemical Vapor Deposition (CVD) of Carbon Dimer on a Diamond (100) Surface and Application of Neural Networks (NN) for Event Probability Predictions. (Thesis). Oklahoma State University. Retrieved from http://hdl.handle.net/11244/10052

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Abdul Samadh, Abdul Nizam. “Molecular Dynamics (MD) Simulations of Chemical Vapor Deposition (CVD) of Carbon Dimer on a Diamond (100) Surface and Application of Neural Networks (NN) for Event Probability Predictions.” 2005. Thesis, Oklahoma State University. Accessed April 12, 2021. http://hdl.handle.net/11244/10052.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Abdul Samadh, Abdul Nizam. “Molecular Dynamics (MD) Simulations of Chemical Vapor Deposition (CVD) of Carbon Dimer on a Diamond (100) Surface and Application of Neural Networks (NN) for Event Probability Predictions.” 2005. Web. 12 Apr 2021.

Vancouver:

Abdul Samadh AN. Molecular Dynamics (MD) Simulations of Chemical Vapor Deposition (CVD) of Carbon Dimer on a Diamond (100) Surface and Application of Neural Networks (NN) for Event Probability Predictions. [Internet] [Thesis]. Oklahoma State University; 2005. [cited 2021 Apr 12]. Available from: http://hdl.handle.net/11244/10052.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Abdul Samadh AN. Molecular Dynamics (MD) Simulations of Chemical Vapor Deposition (CVD) of Carbon Dimer on a Diamond (100) Surface and Application of Neural Networks (NN) for Event Probability Predictions. [Thesis]. Oklahoma State University; 2005. Available from: http://hdl.handle.net/11244/10052

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of Southern California

29. Wei, Tao. Experimental study and atomic simulation of protein adsorption.

Degree: PhD, Chemical Engineering, 2008, University of Southern California

 The studies of protein adsorption at solid-liquid interface are important in various applications. Multilayer and irreversible adsorption behaviors are commonly observed. In this work, protein… (more)

Subjects/Keywords: protein adsorption; FTIR/ATR; MD simulation; hybrid genetic algorithm

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Wei, T. (2008). Experimental study and atomic simulation of protein adsorption. (Doctoral Dissertation). University of Southern California. Retrieved from http://digitallibrary.usc.edu/cdm/compoundobject/collection/p15799coll127/id/121195/rec/2633

Chicago Manual of Style (16th Edition):

Wei, Tao. “Experimental study and atomic simulation of protein adsorption.” 2008. Doctoral Dissertation, University of Southern California. Accessed April 12, 2021. http://digitallibrary.usc.edu/cdm/compoundobject/collection/p15799coll127/id/121195/rec/2633.

MLA Handbook (7th Edition):

Wei, Tao. “Experimental study and atomic simulation of protein adsorption.” 2008. Web. 12 Apr 2021.

Vancouver:

Wei T. Experimental study and atomic simulation of protein adsorption. [Internet] [Doctoral dissertation]. University of Southern California; 2008. [cited 2021 Apr 12]. Available from: http://digitallibrary.usc.edu/cdm/compoundobject/collection/p15799coll127/id/121195/rec/2633.

Council of Science Editors:

Wei T. Experimental study and atomic simulation of protein adsorption. [Doctoral Dissertation]. University of Southern California; 2008. Available from: http://digitallibrary.usc.edu/cdm/compoundobject/collection/p15799coll127/id/121195/rec/2633


University of Tennessee – Knoxville

30. Huang, Zuya. Modeling and Experimental Investigation on the Influence of Radiation Defects on Helium Behavior in BCC Iron.

Degree: MS, Nuclear Engineering, 2016, University of Tennessee – Knoxville

  Fe-based alloys are important structural materials for both fission and fusion energy. For fusion applications, the challenges of radiation-induced changes in microstructure, properties and… (more)

Subjects/Keywords: Helium; Iron; MD Simulation; Thermal Desorption Spectrometry (TDS); Thermal Desorption Spectrum (TDS) Measurement; Mechanics of Materials; Nuclear Engineering; Structural Materials

Record DetailsSimilar RecordsGoogle PlusoneFacebookTwitterCiteULikeMendeleyreddit

APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Huang, Z. (2016). Modeling and Experimental Investigation on the Influence of Radiation Defects on Helium Behavior in BCC Iron. (Thesis). University of Tennessee – Knoxville. Retrieved from https://trace.tennessee.edu/utk_gradthes/3776

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Huang, Zuya. “Modeling and Experimental Investigation on the Influence of Radiation Defects on Helium Behavior in BCC Iron.” 2016. Thesis, University of Tennessee – Knoxville. Accessed April 12, 2021. https://trace.tennessee.edu/utk_gradthes/3776.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Huang, Zuya. “Modeling and Experimental Investigation on the Influence of Radiation Defects on Helium Behavior in BCC Iron.” 2016. Web. 12 Apr 2021.

Vancouver:

Huang Z. Modeling and Experimental Investigation on the Influence of Radiation Defects on Helium Behavior in BCC Iron. [Internet] [Thesis]. University of Tennessee – Knoxville; 2016. [cited 2021 Apr 12]. Available from: https://trace.tennessee.edu/utk_gradthes/3776.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Huang Z. Modeling and Experimental Investigation on the Influence of Radiation Defects on Helium Behavior in BCC Iron. [Thesis]. University of Tennessee – Knoxville; 2016. Available from: https://trace.tennessee.edu/utk_gradthes/3776

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

[1] [2] [3]

.