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You searched for subject:(Molecular dynamics ). Showing records 1 – 30 of 2862 total matches.

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Anna University

1. Priyadarshini M. Studies on periplasmic chaperone lola and outer membrane protein lolb in escherichia coli An analysis of lipoprotein interactions leading to identification of inhibitors a molecular dynamics and in silico study;.

Degree: Studies on periplasmic chaperone lola and outer membrane protein lolb in escherichia coli An analysis of lipoprotein interactions leading to identification of inhibitors a molecular dynamics and in silico study, 2015, Anna University

The crystal structures of LolA and LolB have been solved and extensive studies have been performed on these biomolecules Takeda et al 2003 Despite the… (more)

Subjects/Keywords: Molecular dynamics

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APA (6th Edition):

M, P. (2015). Studies on periplasmic chaperone lola and outer membrane protein lolb in escherichia coli An analysis of lipoprotein interactions leading to identification of inhibitors a molecular dynamics and in silico study;. (Thesis). Anna University. Retrieved from http://shodhganga.inflibnet.ac.in/handle/10603/34560

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):

M, Priyadarshini. “Studies on periplasmic chaperone lola and outer membrane protein lolb in escherichia coli An analysis of lipoprotein interactions leading to identification of inhibitors a molecular dynamics and in silico study;.” 2015. Thesis, Anna University. Accessed October 23, 2019. http://shodhganga.inflibnet.ac.in/handle/10603/34560.

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

MLA Handbook (7th Edition):

M, Priyadarshini. “Studies on periplasmic chaperone lola and outer membrane protein lolb in escherichia coli An analysis of lipoprotein interactions leading to identification of inhibitors a molecular dynamics and in silico study;.” 2015. Web. 23 Oct 2019.

Vancouver:

M P. Studies on periplasmic chaperone lola and outer membrane protein lolb in escherichia coli An analysis of lipoprotein interactions leading to identification of inhibitors a molecular dynamics and in silico study;. [Internet] [Thesis]. Anna University; 2015. [cited 2019 Oct 23]. Available from: http://shodhganga.inflibnet.ac.in/handle/10603/34560.

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

Council of Science Editors:

M P. Studies on periplasmic chaperone lola and outer membrane protein lolb in escherichia coli An analysis of lipoprotein interactions leading to identification of inhibitors a molecular dynamics and in silico study;. [Thesis]. Anna University; 2015. Available from: http://shodhganga.inflibnet.ac.in/handle/10603/34560

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


Rochester Institute of Technology

2. Cyran, Marek. Event-driven molecular dynamics simulations of protein mixtures.

Degree: School of Mathematical Sciences (COS), 2010, Rochester Institute of Technology

 The structure of liquids is central to their thermodynamic properties and is described in a probabilistic manner. The structure is a consequence of the forces… (more)

Subjects/Keywords: Molecular dynamics

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APA (6th Edition):

Cyran, M. (2010). Event-driven molecular dynamics simulations of protein mixtures. (Thesis). Rochester Institute of Technology. Retrieved from https://scholarworks.rit.edu/theses/4978

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):

Cyran, Marek. “Event-driven molecular dynamics simulations of protein mixtures.” 2010. Thesis, Rochester Institute of Technology. Accessed October 23, 2019. https://scholarworks.rit.edu/theses/4978.

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

MLA Handbook (7th Edition):

Cyran, Marek. “Event-driven molecular dynamics simulations of protein mixtures.” 2010. Web. 23 Oct 2019.

Vancouver:

Cyran M. Event-driven molecular dynamics simulations of protein mixtures. [Internet] [Thesis]. Rochester Institute of Technology; 2010. [cited 2019 Oct 23]. Available from: https://scholarworks.rit.edu/theses/4978.

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

Council of Science Editors:

Cyran M. Event-driven molecular dynamics simulations of protein mixtures. [Thesis]. Rochester Institute of Technology; 2010. Available from: https://scholarworks.rit.edu/theses/4978

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


University of Oklahoma

3. Wallace, Jason Avery. CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS.

Degree: PhD, 2012, University of Oklahoma

 Lastly, we combine the generalized reaction field treament of long-range electrostatics and a charge-neutralization procedure which together allow fully explicit-solvent CpHMD (ECpHMD) to deliver pKa… (more)

Subjects/Keywords: Molecular dynamics

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APA (6th Edition):

Wallace, J. A. (2012). CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS. (Doctoral Dissertation). University of Oklahoma. Retrieved from http://hdl.handle.net/11244/319485

Chicago Manual of Style (16th Edition):

Wallace, Jason Avery. “CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS.” 2012. Doctoral Dissertation, University of Oklahoma. Accessed October 23, 2019. http://hdl.handle.net/11244/319485.

MLA Handbook (7th Edition):

Wallace, Jason Avery. “CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS.” 2012. Web. 23 Oct 2019.

Vancouver:

Wallace JA. CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS. [Internet] [Doctoral dissertation]. University of Oklahoma; 2012. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/11244/319485.

Council of Science Editors:

Wallace JA. CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS. [Doctoral Dissertation]. University of Oklahoma; 2012. Available from: http://hdl.handle.net/11244/319485


University of Oklahoma

4. Wallace, Jason Avery. CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS.

Degree: PhD, 2012, University of Oklahoma

 Lastly, we combine the generalized reaction field treament of long-range electrostatics and a charge-neutralization procedure which together allow fully explicit-solvent CpHMD (ECpHMD) to deliver pKa… (more)

Subjects/Keywords: Molecular dynamics

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APA (6th Edition):

Wallace, J. A. (2012). CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS. (Doctoral Dissertation). University of Oklahoma. Retrieved from http://hdl.handle.net/11244/318535

Chicago Manual of Style (16th Edition):

Wallace, Jason Avery. “CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS.” 2012. Doctoral Dissertation, University of Oklahoma. Accessed October 23, 2019. http://hdl.handle.net/11244/318535.

MLA Handbook (7th Edition):

Wallace, Jason Avery. “CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS.” 2012. Web. 23 Oct 2019.

Vancouver:

Wallace JA. CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS. [Internet] [Doctoral dissertation]. University of Oklahoma; 2012. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/11244/318535.

Council of Science Editors:

Wallace JA. CONSTANT-pH MOLECULAR DYNAMICS SIMULATIONS: DEVELOPMENT AND APPLICATIONS. [Doctoral Dissertation]. University of Oklahoma; 2012. Available from: http://hdl.handle.net/11244/318535


Rutgers University

5. Diaz, Ricardo, 1983-. Molecular dynamics studies of nanoscale evaporation and pool boiling heat transfer on modified surfaces.

Degree: PhD, Mechanical and Aerospace Engineering, 2018, Rutgers University

Phase change has long been known to be an efficient method of heat transfer, due to the latent energy released at constant or near-constant temperature.… (more)

Subjects/Keywords: Molecular dynamics

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APA (6th Edition):

Diaz, Ricardo, 1. (2018). Molecular dynamics studies of nanoscale evaporation and pool boiling heat transfer on modified surfaces. (Doctoral Dissertation). Rutgers University. Retrieved from https://rucore.libraries.rutgers.edu/rutgers-lib/57537/

Chicago Manual of Style (16th Edition):

Diaz, Ricardo, 1983-. “Molecular dynamics studies of nanoscale evaporation and pool boiling heat transfer on modified surfaces.” 2018. Doctoral Dissertation, Rutgers University. Accessed October 23, 2019. https://rucore.libraries.rutgers.edu/rutgers-lib/57537/.

MLA Handbook (7th Edition):

Diaz, Ricardo, 1983-. “Molecular dynamics studies of nanoscale evaporation and pool boiling heat transfer on modified surfaces.” 2018. Web. 23 Oct 2019.

Vancouver:

Diaz, Ricardo 1. Molecular dynamics studies of nanoscale evaporation and pool boiling heat transfer on modified surfaces. [Internet] [Doctoral dissertation]. Rutgers University; 2018. [cited 2019 Oct 23]. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/57537/.

Council of Science Editors:

Diaz, Ricardo 1. Molecular dynamics studies of nanoscale evaporation and pool boiling heat transfer on modified surfaces. [Doctoral Dissertation]. Rutgers University; 2018. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/57537/


Hong Kong University of Science and Technology

6. Liu, Chong. Molecular dynamics simulation of nanochannel flows.

Degree: 2011, Hong Kong University of Science and Technology

 Nanoscale fluid flow systems involve both microscopic and macroscopic parameters, which may couple with each another and lead to many special properties. The primary objective… (more)

Subjects/Keywords: Nanofluids; Molecular dynamics; Fluid dynamics

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APA (6th Edition):

Liu, C. (2011). Molecular dynamics simulation of nanochannel flows. (Thesis). Hong Kong University of Science and Technology. Retrieved from https://doi.org/10.14711/thesis-b1146181 ; http://repository.ust.hk/ir/bitstream/1783.1-7201/1/th_redirect.html

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):

Liu, Chong. “Molecular dynamics simulation of nanochannel flows.” 2011. Thesis, Hong Kong University of Science and Technology. Accessed October 23, 2019. https://doi.org/10.14711/thesis-b1146181 ; http://repository.ust.hk/ir/bitstream/1783.1-7201/1/th_redirect.html.

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

MLA Handbook (7th Edition):

Liu, Chong. “Molecular dynamics simulation of nanochannel flows.” 2011. Web. 23 Oct 2019.

Vancouver:

Liu C. Molecular dynamics simulation of nanochannel flows. [Internet] [Thesis]. Hong Kong University of Science and Technology; 2011. [cited 2019 Oct 23]. Available from: https://doi.org/10.14711/thesis-b1146181 ; http://repository.ust.hk/ir/bitstream/1783.1-7201/1/th_redirect.html.

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

Council of Science Editors:

Liu C. Molecular dynamics simulation of nanochannel flows. [Thesis]. Hong Kong University of Science and Technology; 2011. Available from: https://doi.org/10.14711/thesis-b1146181 ; http://repository.ust.hk/ir/bitstream/1783.1-7201/1/th_redirect.html

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


University of Alberta

7. Zhou,Yang. Molecular Dynamics Study of A Water Soluble, Upper Critical Solution Temperature Polymer.

Degree: MS, Department of Chemical and Materials Engineering, 2014, University of Alberta

 Thermo-responsive polymers have been the subject of research in academic and applied science over the past few decades. Among them, water-soluble thermo-responsive polymers draw most… (more)

Subjects/Keywords: Molecular dynamics simulation

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APA (6th Edition):

Zhou,Yang. (2014). Molecular Dynamics Study of A Water Soluble, Upper Critical Solution Temperature Polymer. (Masters Thesis). University of Alberta. Retrieved from https://era.library.ualberta.ca/files/rb68xf375

Note: this citation may be lacking information needed for this citation format:
Author name may be incomplete

Chicago Manual of Style (16th Edition):

Zhou,Yang. “Molecular Dynamics Study of A Water Soluble, Upper Critical Solution Temperature Polymer.” 2014. Masters Thesis, University of Alberta. Accessed October 23, 2019. https://era.library.ualberta.ca/files/rb68xf375.

Note: this citation may be lacking information needed for this citation format:
Author name may be incomplete

MLA Handbook (7th Edition):

Zhou,Yang. “Molecular Dynamics Study of A Water Soluble, Upper Critical Solution Temperature Polymer.” 2014. Web. 23 Oct 2019.

Note: this citation may be lacking information needed for this citation format:
Author name may be incomplete

Vancouver:

Zhou,Yang. Molecular Dynamics Study of A Water Soluble, Upper Critical Solution Temperature Polymer. [Internet] [Masters thesis]. University of Alberta; 2014. [cited 2019 Oct 23]. Available from: https://era.library.ualberta.ca/files/rb68xf375.

Note: this citation may be lacking information needed for this citation format:
Author name may be incomplete

Council of Science Editors:

Zhou,Yang. Molecular Dynamics Study of A Water Soluble, Upper Critical Solution Temperature Polymer. [Masters Thesis]. University of Alberta; 2014. Available from: https://era.library.ualberta.ca/files/rb68xf375

Note: this citation may be lacking information needed for this citation format:
Author name may be incomplete


Texas A&M University

8. Atilhan, Selma. Molecular dynamics simulation of montmorillonite and mechanical and thermodynamic properties calculations.

Degree: 2009, Texas A&M University

 Nanocomposites refer to the materials in which the defining characteristic size of inclusions is in the order of 10-100nm. There are several types of nanoparticle… (more)

Subjects/Keywords: Molecular dynamics; Montmorillonite

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APA (6th Edition):

Atilhan, S. (2009). Molecular dynamics simulation of montmorillonite and mechanical and thermodynamic properties calculations. (Thesis). Texas A&M University. Retrieved from http://hdl.handle.net/1969.1/ETD-TAMU-1263

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):

Atilhan, Selma. “Molecular dynamics simulation of montmorillonite and mechanical and thermodynamic properties calculations.” 2009. Thesis, Texas A&M University. Accessed October 23, 2019. http://hdl.handle.net/1969.1/ETD-TAMU-1263.

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

MLA Handbook (7th Edition):

Atilhan, Selma. “Molecular dynamics simulation of montmorillonite and mechanical and thermodynamic properties calculations.” 2009. Web. 23 Oct 2019.

Vancouver:

Atilhan S. Molecular dynamics simulation of montmorillonite and mechanical and thermodynamic properties calculations. [Internet] [Thesis]. Texas A&M University; 2009. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/1969.1/ETD-TAMU-1263.

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

Council of Science Editors:

Atilhan S. Molecular dynamics simulation of montmorillonite and mechanical and thermodynamic properties calculations. [Thesis]. Texas A&M University; 2009. Available from: http://hdl.handle.net/1969.1/ETD-TAMU-1263

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


Victoria University of Wellington

9. Mahelona, Keoni Kealoha. Molecular Dynamics: A Study on Slip, Drops, and Graphene.

Degree: 2011, Victoria University of Wellington

Molecular dynamics (MD) is a computational tool used to study physical systems by modeling the atomic-scale interactions between atoms. MD can accurately predict the properties… (more)

Subjects/Keywords: Molecular dynamics; Liquids

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APA (6th Edition):

Mahelona, K. K. (2011). Molecular Dynamics: A Study on Slip, Drops, and Graphene. (Masters Thesis). Victoria University of Wellington. Retrieved from http://hdl.handle.net/10063/1975

Chicago Manual of Style (16th Edition):

Mahelona, Keoni Kealoha. “Molecular Dynamics: A Study on Slip, Drops, and Graphene.” 2011. Masters Thesis, Victoria University of Wellington. Accessed October 23, 2019. http://hdl.handle.net/10063/1975.

MLA Handbook (7th Edition):

Mahelona, Keoni Kealoha. “Molecular Dynamics: A Study on Slip, Drops, and Graphene.” 2011. Web. 23 Oct 2019.

Vancouver:

Mahelona KK. Molecular Dynamics: A Study on Slip, Drops, and Graphene. [Internet] [Masters thesis]. Victoria University of Wellington; 2011. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/10063/1975.

Council of Science Editors:

Mahelona KK. Molecular Dynamics: A Study on Slip, Drops, and Graphene. [Masters Thesis]. Victoria University of Wellington; 2011. Available from: http://hdl.handle.net/10063/1975


University of Hong Kong

10. 张青; Zhang, Qing. A theory of Ehrenfest dynamics for open systems and its applications.

Degree: PhD, 2015, University of Hong Kong

In conventional mixed electron-nuclear molecular dynamics simulations, the molecular systems are always treated as closed. Here starting from the exact quantum mechanical Lagrangian, a first… (more)

Subjects/Keywords: Molecular dynamics; Electrons

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APA (6th Edition):

张青; Zhang, Q. (2015). A theory of Ehrenfest dynamics for open systems and its applications. (Doctoral Dissertation). University of Hong Kong. Retrieved from Zhang, Q. [张青]. (2015). A theory of Ehrenfest dynamics for open systems and its applications. (Thesis). University of Hong Kong, Pokfulam, Hong Kong SAR. Retrieved from http://dx.doi.org/10.5353/th_b5699946 ; http://hdl.handle.net/10722/223020

Chicago Manual of Style (16th Edition):

张青; Zhang, Qing. “A theory of Ehrenfest dynamics for open systems and its applications.” 2015. Doctoral Dissertation, University of Hong Kong. Accessed October 23, 2019. Zhang, Q. [张青]. (2015). A theory of Ehrenfest dynamics for open systems and its applications. (Thesis). University of Hong Kong, Pokfulam, Hong Kong SAR. Retrieved from http://dx.doi.org/10.5353/th_b5699946 ; http://hdl.handle.net/10722/223020.

MLA Handbook (7th Edition):

张青; Zhang, Qing. “A theory of Ehrenfest dynamics for open systems and its applications.” 2015. Web. 23 Oct 2019.

Vancouver:

张青; Zhang Q. A theory of Ehrenfest dynamics for open systems and its applications. [Internet] [Doctoral dissertation]. University of Hong Kong; 2015. [cited 2019 Oct 23]. Available from: Zhang, Q. [张青]. (2015). A theory of Ehrenfest dynamics for open systems and its applications. (Thesis). University of Hong Kong, Pokfulam, Hong Kong SAR. Retrieved from http://dx.doi.org/10.5353/th_b5699946 ; http://hdl.handle.net/10722/223020.

Council of Science Editors:

张青; Zhang Q. A theory of Ehrenfest dynamics for open systems and its applications. [Doctoral Dissertation]. University of Hong Kong; 2015. Available from: Zhang, Q. [张青]. (2015). A theory of Ehrenfest dynamics for open systems and its applications. (Thesis). University of Hong Kong, Pokfulam, Hong Kong SAR. Retrieved from http://dx.doi.org/10.5353/th_b5699946 ; http://hdl.handle.net/10722/223020


University of Manchester

11. Gowers, Richard. Developing dual-scale models for structured liquids and polymeric materials.

Degree: 2016, University of Manchester

 Computer simulation techniques for exploring the microscopic world are quickly gaining popularity as a tool to complement theoretical and experimental approaches. Molecular dynamics (MD) simulations… (more)

Subjects/Keywords: molecular dynamics; multiscale

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APA (6th Edition):

Gowers, R. (2016). Developing dual-scale models for structured liquids and polymeric materials. (Doctoral Dissertation). University of Manchester. Retrieved from http://www.manchester.ac.uk/escholar/uk-ac-man-scw:301532

Chicago Manual of Style (16th Edition):

Gowers, Richard. “Developing dual-scale models for structured liquids and polymeric materials.” 2016. Doctoral Dissertation, University of Manchester. Accessed October 23, 2019. http://www.manchester.ac.uk/escholar/uk-ac-man-scw:301532.

MLA Handbook (7th Edition):

Gowers, Richard. “Developing dual-scale models for structured liquids and polymeric materials.” 2016. Web. 23 Oct 2019.

Vancouver:

Gowers R. Developing dual-scale models for structured liquids and polymeric materials. [Internet] [Doctoral dissertation]. University of Manchester; 2016. [cited 2019 Oct 23]. Available from: http://www.manchester.ac.uk/escholar/uk-ac-man-scw:301532.

Council of Science Editors:

Gowers R. Developing dual-scale models for structured liquids and polymeric materials. [Doctoral Dissertation]. University of Manchester; 2016. Available from: http://www.manchester.ac.uk/escholar/uk-ac-man-scw:301532


McMaster University

12. Saidi, Peyman. Simulation Based Study of Solidification in Aluminum-Silicon System.

Degree: PhD, 2015, McMaster University

Using molecular dynamics (MD) and boundary element method (BEM), different aspects of solidification in the aluminum silicon system are studied. The angular embedding atom model… (more)

Subjects/Keywords: Molecular Dynamics; Solidification

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APA (6th Edition):

Saidi, P. (2015). Simulation Based Study of Solidification in Aluminum-Silicon System. (Doctoral Dissertation). McMaster University. Retrieved from http://hdl.handle.net/11375/18358

Chicago Manual of Style (16th Edition):

Saidi, Peyman. “Simulation Based Study of Solidification in Aluminum-Silicon System.” 2015. Doctoral Dissertation, McMaster University. Accessed October 23, 2019. http://hdl.handle.net/11375/18358.

MLA Handbook (7th Edition):

Saidi, Peyman. “Simulation Based Study of Solidification in Aluminum-Silicon System.” 2015. Web. 23 Oct 2019.

Vancouver:

Saidi P. Simulation Based Study of Solidification in Aluminum-Silicon System. [Internet] [Doctoral dissertation]. McMaster University; 2015. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/11375/18358.

Council of Science Editors:

Saidi P. Simulation Based Study of Solidification in Aluminum-Silicon System. [Doctoral Dissertation]. McMaster University; 2015. Available from: http://hdl.handle.net/11375/18358


Cornell University

13. Pochodylo, Amy. Metal Complexation By Phytochelatins And Microcystins: A Molecular Dynamics Study .

Degree: 2014, Cornell University

 A better understanding of the metal-peptide complexes formed by phytochelatins and microcystins is necessary to understand the role of these peptides in algal cells and… (more)

Subjects/Keywords: microcystins; molecular dynamics

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APA (6th Edition):

Pochodylo, A. (2014). Metal Complexation By Phytochelatins And Microcystins: A Molecular Dynamics Study . (Thesis). Cornell University. Retrieved from http://hdl.handle.net/1813/37018

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):

Pochodylo, Amy. “Metal Complexation By Phytochelatins And Microcystins: A Molecular Dynamics Study .” 2014. Thesis, Cornell University. Accessed October 23, 2019. http://hdl.handle.net/1813/37018.

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

MLA Handbook (7th Edition):

Pochodylo, Amy. “Metal Complexation By Phytochelatins And Microcystins: A Molecular Dynamics Study .” 2014. Web. 23 Oct 2019.

Vancouver:

Pochodylo A. Metal Complexation By Phytochelatins And Microcystins: A Molecular Dynamics Study . [Internet] [Thesis]. Cornell University; 2014. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/1813/37018.

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

Council of Science Editors:

Pochodylo A. Metal Complexation By Phytochelatins And Microcystins: A Molecular Dynamics Study . [Thesis]. Cornell University; 2014. Available from: http://hdl.handle.net/1813/37018

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


University of Oklahoma

14. Konatham, Deepthi. Equilibrium and Transport Properties of Systems Containing Graphene Sheets (-Oil Nanocomposites and Membranes) from Molecular Dynamics Simulations.

Degree: PhD, 2014, University of Oklahoma

 In the second part of the thesis umbrella sampling simulations were employed to study the transport of water molecules and ions through the membranes incorporating… (more)

Subjects/Keywords: graphene; molecular dynamics

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APA (6th Edition):

Konatham, D. (2014). Equilibrium and Transport Properties of Systems Containing Graphene Sheets (-Oil Nanocomposites and Membranes) from Molecular Dynamics Simulations. (Doctoral Dissertation). University of Oklahoma. Retrieved from http://hdl.handle.net/11244/13876

Chicago Manual of Style (16th Edition):

Konatham, Deepthi. “Equilibrium and Transport Properties of Systems Containing Graphene Sheets (-Oil Nanocomposites and Membranes) from Molecular Dynamics Simulations.” 2014. Doctoral Dissertation, University of Oklahoma. Accessed October 23, 2019. http://hdl.handle.net/11244/13876.

MLA Handbook (7th Edition):

Konatham, Deepthi. “Equilibrium and Transport Properties of Systems Containing Graphene Sheets (-Oil Nanocomposites and Membranes) from Molecular Dynamics Simulations.” 2014. Web. 23 Oct 2019.

Vancouver:

Konatham D. Equilibrium and Transport Properties of Systems Containing Graphene Sheets (-Oil Nanocomposites and Membranes) from Molecular Dynamics Simulations. [Internet] [Doctoral dissertation]. University of Oklahoma; 2014. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/11244/13876.

Council of Science Editors:

Konatham D. Equilibrium and Transport Properties of Systems Containing Graphene Sheets (-Oil Nanocomposites and Membranes) from Molecular Dynamics Simulations. [Doctoral Dissertation]. University of Oklahoma; 2014. Available from: http://hdl.handle.net/11244/13876

15. Bao, Jie. Ultrafast Photoelectron Spectroscopy and Mass Spectrometry as Probes for Structural Dynamics of Highly Excited Large Molecular Systems.

Degree: PhD, Chemistry, 2011, Brown University

 Understanding the molecular structural dynamics of highly excited, large molecules on various dynamics levels has been a challenge for both experimentalists and theorists. We approach… (more)

Subjects/Keywords: Ultrafast Molecular Dynamics

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APA (6th Edition):

Bao, J. (2011). Ultrafast Photoelectron Spectroscopy and Mass Spectrometry as Probes for Structural Dynamics of Highly Excited Large Molecular Systems. (Doctoral Dissertation). Brown University. Retrieved from https://repository.library.brown.edu/studio/item/bdr:11189/

Chicago Manual of Style (16th Edition):

Bao, Jie. “Ultrafast Photoelectron Spectroscopy and Mass Spectrometry as Probes for Structural Dynamics of Highly Excited Large Molecular Systems.” 2011. Doctoral Dissertation, Brown University. Accessed October 23, 2019. https://repository.library.brown.edu/studio/item/bdr:11189/.

MLA Handbook (7th Edition):

Bao, Jie. “Ultrafast Photoelectron Spectroscopy and Mass Spectrometry as Probes for Structural Dynamics of Highly Excited Large Molecular Systems.” 2011. Web. 23 Oct 2019.

Vancouver:

Bao J. Ultrafast Photoelectron Spectroscopy and Mass Spectrometry as Probes for Structural Dynamics of Highly Excited Large Molecular Systems. [Internet] [Doctoral dissertation]. Brown University; 2011. [cited 2019 Oct 23]. Available from: https://repository.library.brown.edu/studio/item/bdr:11189/.

Council of Science Editors:

Bao J. Ultrafast Photoelectron Spectroscopy and Mass Spectrometry as Probes for Structural Dynamics of Highly Excited Large Molecular Systems. [Doctoral Dissertation]. Brown University; 2011. Available from: https://repository.library.brown.edu/studio/item/bdr:11189/

16. Raviprasad, Muniyamuthu. Influence of Molecular Interactions on Elastic Properties and Oxygen Diffusion in PolyButylene Terephthalate Polymer: A Molecular Dynamics Study.

Degree: MS, Civil and Environmental Engineering, 2012, North Dakota State University

 In most barrier applications, both mechanical and diffusion properties of the material are important. In this thesis the evaluation of molecular mechanisms responsible for the… (more)

Subjects/Keywords: Polybutenes; Molecular dynamics

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APA (6th Edition):

Raviprasad, M. (2012). Influence of Molecular Interactions on Elastic Properties and Oxygen Diffusion in PolyButylene Terephthalate Polymer: A Molecular Dynamics Study. (Masters Thesis). North Dakota State University. Retrieved from http://hdl.handle.net/10365/26732

Chicago Manual of Style (16th Edition):

Raviprasad, Muniyamuthu. “Influence of Molecular Interactions on Elastic Properties and Oxygen Diffusion in PolyButylene Terephthalate Polymer: A Molecular Dynamics Study.” 2012. Masters Thesis, North Dakota State University. Accessed October 23, 2019. http://hdl.handle.net/10365/26732.

MLA Handbook (7th Edition):

Raviprasad, Muniyamuthu. “Influence of Molecular Interactions on Elastic Properties and Oxygen Diffusion in PolyButylene Terephthalate Polymer: A Molecular Dynamics Study.” 2012. Web. 23 Oct 2019.

Vancouver:

Raviprasad M. Influence of Molecular Interactions on Elastic Properties and Oxygen Diffusion in PolyButylene Terephthalate Polymer: A Molecular Dynamics Study. [Internet] [Masters thesis]. North Dakota State University; 2012. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/10365/26732.

Council of Science Editors:

Raviprasad M. Influence of Molecular Interactions on Elastic Properties and Oxygen Diffusion in PolyButylene Terephthalate Polymer: A Molecular Dynamics Study. [Masters Thesis]. North Dakota State University; 2012. Available from: http://hdl.handle.net/10365/26732


Rutgers University

17. Li, Ting, 1989-. Study the interaction between hydrophilic silica surface and planar DMPC bilayers by using molecular dynamics.

Degree: MS, Chemical and Biochemical Engineering, 2016, Rutgers University

 This work studies the interaction of lipid bilayer with hydrophilic silica surface. Main attention is paid to the dependence of the disjoining pressure Π on… (more)

Subjects/Keywords: Molecular dynamics; Silica

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APA (6th Edition):

Li, Ting, 1. (2016). Study the interaction between hydrophilic silica surface and planar DMPC bilayers by using molecular dynamics. (Masters Thesis). Rutgers University. Retrieved from https://rucore.libraries.rutgers.edu/rutgers-lib/49254/

Chicago Manual of Style (16th Edition):

Li, Ting, 1989-. “Study the interaction between hydrophilic silica surface and planar DMPC bilayers by using molecular dynamics.” 2016. Masters Thesis, Rutgers University. Accessed October 23, 2019. https://rucore.libraries.rutgers.edu/rutgers-lib/49254/.

MLA Handbook (7th Edition):

Li, Ting, 1989-. “Study the interaction between hydrophilic silica surface and planar DMPC bilayers by using molecular dynamics.” 2016. Web. 23 Oct 2019.

Vancouver:

Li, Ting 1. Study the interaction between hydrophilic silica surface and planar DMPC bilayers by using molecular dynamics. [Internet] [Masters thesis]. Rutgers University; 2016. [cited 2019 Oct 23]. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/49254/.

Council of Science Editors:

Li, Ting 1. Study the interaction between hydrophilic silica surface and planar DMPC bilayers by using molecular dynamics. [Masters Thesis]. Rutgers University; 2016. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/49254/


Rutgers University

18. Whittaker, John W., 1992-. Molecular dynamics simulations of biopolymers in materials science and medicine.

Degree: MS, Computational and Integrative Biology, 2018, Rutgers University

 Biopolymers are the molecular building blocks of the natural world and are a focal point of many areas of active research. Despite their universality, many… (more)

Subjects/Keywords: Biopolymers; Molecular dynamics

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APA (6th Edition):

Whittaker, John W., 1. (2018). Molecular dynamics simulations of biopolymers in materials science and medicine. (Masters Thesis). Rutgers University. Retrieved from https://rucore.libraries.rutgers.edu/rutgers-lib/57089/

Chicago Manual of Style (16th Edition):

Whittaker, John W., 1992-. “Molecular dynamics simulations of biopolymers in materials science and medicine.” 2018. Masters Thesis, Rutgers University. Accessed October 23, 2019. https://rucore.libraries.rutgers.edu/rutgers-lib/57089/.

MLA Handbook (7th Edition):

Whittaker, John W., 1992-. “Molecular dynamics simulations of biopolymers in materials science and medicine.” 2018. Web. 23 Oct 2019.

Vancouver:

Whittaker, John W. 1. Molecular dynamics simulations of biopolymers in materials science and medicine. [Internet] [Masters thesis]. Rutgers University; 2018. [cited 2019 Oct 23]. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/57089/.

Council of Science Editors:

Whittaker, John W. 1. Molecular dynamics simulations of biopolymers in materials science and medicine. [Masters Thesis]. Rutgers University; 2018. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/57089/


Rutgers University

19. Yin, Tianya, 1989-. Molecular dynamics simulation on the mobilization of deposited nanoparticles by a moving interface.

Degree: PhD, Chemical and Biochemical Engineering, 2019, Rutgers University

It is now generally accepted that aside from liquid and gaseous phases, the solid phase is also responsible for contaminant transport in subsurface media. Understanding… (more)

Subjects/Keywords: Molecular dynamics; Nanoparticles

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APA (6th Edition):

Yin, Tianya, 1. (2019). Molecular dynamics simulation on the mobilization of deposited nanoparticles by a moving interface. (Doctoral Dissertation). Rutgers University. Retrieved from https://rucore.libraries.rutgers.edu/rutgers-lib/60107/

Chicago Manual of Style (16th Edition):

Yin, Tianya, 1989-. “Molecular dynamics simulation on the mobilization of deposited nanoparticles by a moving interface.” 2019. Doctoral Dissertation, Rutgers University. Accessed October 23, 2019. https://rucore.libraries.rutgers.edu/rutgers-lib/60107/.

MLA Handbook (7th Edition):

Yin, Tianya, 1989-. “Molecular dynamics simulation on the mobilization of deposited nanoparticles by a moving interface.” 2019. Web. 23 Oct 2019.

Vancouver:

Yin, Tianya 1. Molecular dynamics simulation on the mobilization of deposited nanoparticles by a moving interface. [Internet] [Doctoral dissertation]. Rutgers University; 2019. [cited 2019 Oct 23]. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/60107/.

Council of Science Editors:

Yin, Tianya 1. Molecular dynamics simulation on the mobilization of deposited nanoparticles by a moving interface. [Doctoral Dissertation]. Rutgers University; 2019. Available from: https://rucore.libraries.rutgers.edu/rutgers-lib/60107/


Hong Kong University of Science and Technology

20. Lv, Ya. Molecular dynamics (MD) simulation of nanoscale confined fluids under temperature gradients and their applications in thermal systems.

Degree: 2013, Hong Kong University of Science and Technology

 The dynamic behaviors of nanoscale confined fluids under temperature gradients can be different from that of bulk fluids. This is because temperature gradients and fluid-wall… (more)

Subjects/Keywords: Molecular dynamics; Nanostructured materials; Fluid dynamics

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APA (6th Edition):

Lv, Y. (2013). Molecular dynamics (MD) simulation of nanoscale confined fluids under temperature gradients and their applications in thermal systems. (Thesis). Hong Kong University of Science and Technology. Retrieved from https://doi.org/10.14711/thesis-b1214686 ; http://repository.ust.hk/ir/bitstream/1783.1-7876/1/th_redirect.html

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):

Lv, Ya. “Molecular dynamics (MD) simulation of nanoscale confined fluids under temperature gradients and their applications in thermal systems.” 2013. Thesis, Hong Kong University of Science and Technology. Accessed October 23, 2019. https://doi.org/10.14711/thesis-b1214686 ; http://repository.ust.hk/ir/bitstream/1783.1-7876/1/th_redirect.html.

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

MLA Handbook (7th Edition):

Lv, Ya. “Molecular dynamics (MD) simulation of nanoscale confined fluids under temperature gradients and their applications in thermal systems.” 2013. Web. 23 Oct 2019.

Vancouver:

Lv Y. Molecular dynamics (MD) simulation of nanoscale confined fluids under temperature gradients and their applications in thermal systems. [Internet] [Thesis]. Hong Kong University of Science and Technology; 2013. [cited 2019 Oct 23]. Available from: https://doi.org/10.14711/thesis-b1214686 ; http://repository.ust.hk/ir/bitstream/1783.1-7876/1/th_redirect.html.

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

Council of Science Editors:

Lv Y. Molecular dynamics (MD) simulation of nanoscale confined fluids under temperature gradients and their applications in thermal systems. [Thesis]. Hong Kong University of Science and Technology; 2013. Available from: https://doi.org/10.14711/thesis-b1214686 ; http://repository.ust.hk/ir/bitstream/1783.1-7876/1/th_redirect.html

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

21. Terämä, Emma. Transport Phenomena of Polar Biomolecules and Colloids, Perspectives Through Simulation.

Degree: 2007, University of Helsinki, Helsinki Institute of Physics

The thesis focuses on the transport of polar biomolecules and colloid particles studied through atomistic and coarse-grained simulation techniques. The thesis is comprised of two… (more)

Subjects/Keywords: lipid membrane; dielectrophoresis; molecular dynamics

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APA (6th Edition):

Terämä, E. (2007). Transport Phenomena of Polar Biomolecules and Colloids, Perspectives Through Simulation. (Thesis). University of Helsinki, Helsinki Institute of Physics. Retrieved from http://lib.tkk.fi/Diss/2007/isbn9521029633/

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):

Terämä, Emma. “Transport Phenomena of Polar Biomolecules and Colloids, Perspectives Through Simulation.” 2007. Thesis, University of Helsinki, Helsinki Institute of Physics. Accessed October 23, 2019. http://lib.tkk.fi/Diss/2007/isbn9521029633/.

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

MLA Handbook (7th Edition):

Terämä, Emma. “Transport Phenomena of Polar Biomolecules and Colloids, Perspectives Through Simulation.” 2007. Web. 23 Oct 2019.

Vancouver:

Terämä E. Transport Phenomena of Polar Biomolecules and Colloids, Perspectives Through Simulation. [Internet] [Thesis]. University of Helsinki, Helsinki Institute of Physics; 2007. [cited 2019 Oct 23]. Available from: http://lib.tkk.fi/Diss/2007/isbn9521029633/.

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

Council of Science Editors:

Terämä E. Transport Phenomena of Polar Biomolecules and Colloids, Perspectives Through Simulation. [Thesis]. University of Helsinki, Helsinki Institute of Physics; 2007. Available from: http://lib.tkk.fi/Diss/2007/isbn9521029633/

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


University of South Australia

22. Galea, Toni-Marie. Molecular dynamics simulations of shear in fluids and slip at the solid boundary.

Degree: PhD, 2003, University of South Australia

Subjects/Keywords: Molecular dynamics

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APA (6th Edition):

Galea, T. (2003). Molecular dynamics simulations of shear in fluids and slip at the solid boundary. (Doctoral Dissertation). University of South Australia. Retrieved from http://arrow.unisa.edu.au:8081/1959.8/81041 ; http://arrow.unisa.edu.au/vital/access/manager/Repository/unisa:43759

Chicago Manual of Style (16th Edition):

Galea, Toni-Marie. “Molecular dynamics simulations of shear in fluids and slip at the solid boundary.” 2003. Doctoral Dissertation, University of South Australia. Accessed October 23, 2019. http://arrow.unisa.edu.au:8081/1959.8/81041 ; http://arrow.unisa.edu.au/vital/access/manager/Repository/unisa:43759.

MLA Handbook (7th Edition):

Galea, Toni-Marie. “Molecular dynamics simulations of shear in fluids and slip at the solid boundary.” 2003. Web. 23 Oct 2019.

Vancouver:

Galea T. Molecular dynamics simulations of shear in fluids and slip at the solid boundary. [Internet] [Doctoral dissertation]. University of South Australia; 2003. [cited 2019 Oct 23]. Available from: http://arrow.unisa.edu.au:8081/1959.8/81041 ; http://arrow.unisa.edu.au/vital/access/manager/Repository/unisa:43759.

Council of Science Editors:

Galea T. Molecular dynamics simulations of shear in fluids and slip at the solid boundary. [Doctoral Dissertation]. University of South Australia; 2003. Available from: http://arrow.unisa.edu.au:8081/1959.8/81041 ; http://arrow.unisa.edu.au/vital/access/manager/Repository/unisa:43759


University of Georgia

23. Barnes, Jarrod Wesley. Molecular dynamics simulation of the endopolygalacturonase II – octagalacturonate complex.

Degree: MS, Biochemistry and Molecular Biology, 2004, University of Georgia

 The endopolygalacturonase II enzyme from A. niger was studied with an octameric fragment of -1,4-D-polygalacturonic acid. We present an approach to modeling the complex using… (more)

Subjects/Keywords: Molecular Dynamics

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APA (6th Edition):

Barnes, J. W. (2004). Molecular dynamics simulation of the endopolygalacturonase II – octagalacturonate complex. (Masters Thesis). University of Georgia. Retrieved from http://purl.galileo.usg.edu/uga_etd/barnes_jarrod_w_200412_ms

Chicago Manual of Style (16th Edition):

Barnes, Jarrod Wesley. “Molecular dynamics simulation of the endopolygalacturonase II – octagalacturonate complex.” 2004. Masters Thesis, University of Georgia. Accessed October 23, 2019. http://purl.galileo.usg.edu/uga_etd/barnes_jarrod_w_200412_ms.

MLA Handbook (7th Edition):

Barnes, Jarrod Wesley. “Molecular dynamics simulation of the endopolygalacturonase II – octagalacturonate complex.” 2004. Web. 23 Oct 2019.

Vancouver:

Barnes JW. Molecular dynamics simulation of the endopolygalacturonase II – octagalacturonate complex. [Internet] [Masters thesis]. University of Georgia; 2004. [cited 2019 Oct 23]. Available from: http://purl.galileo.usg.edu/uga_etd/barnes_jarrod_w_200412_ms.

Council of Science Editors:

Barnes JW. Molecular dynamics simulation of the endopolygalacturonase II – octagalacturonate complex. [Masters Thesis]. University of Georgia; 2004. Available from: http://purl.galileo.usg.edu/uga_etd/barnes_jarrod_w_200412_ms

24. Jian, Cuiying. Molecular Dynamics Investigation on the Aggregation of Polyaromatic Compounds in Water and Organic Solvents.

Degree: PhD, Department of Mechanical Engineering, 2015, University of Alberta

 Aggregation of polyaromatic (PA) compounds has drawn great interest due to their wide impacts in areas such as petroleum processing. Despite the extensive studies on… (more)

Subjects/Keywords: Molecular dynamics; Polyaromatic compounds; Aggregation

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APA (6th Edition):

Jian, C. (2015). Molecular Dynamics Investigation on the Aggregation of Polyaromatic Compounds in Water and Organic Solvents. (Doctoral Dissertation). University of Alberta. Retrieved from https://era.library.ualberta.ca/files/qj72p9692

Chicago Manual of Style (16th Edition):

Jian, Cuiying. “Molecular Dynamics Investigation on the Aggregation of Polyaromatic Compounds in Water and Organic Solvents.” 2015. Doctoral Dissertation, University of Alberta. Accessed October 23, 2019. https://era.library.ualberta.ca/files/qj72p9692.

MLA Handbook (7th Edition):

Jian, Cuiying. “Molecular Dynamics Investigation on the Aggregation of Polyaromatic Compounds in Water and Organic Solvents.” 2015. Web. 23 Oct 2019.

Vancouver:

Jian C. Molecular Dynamics Investigation on the Aggregation of Polyaromatic Compounds in Water and Organic Solvents. [Internet] [Doctoral dissertation]. University of Alberta; 2015. [cited 2019 Oct 23]. Available from: https://era.library.ualberta.ca/files/qj72p9692.

Council of Science Editors:

Jian C. Molecular Dynamics Investigation on the Aggregation of Polyaromatic Compounds in Water and Organic Solvents. [Doctoral Dissertation]. University of Alberta; 2015. Available from: https://era.library.ualberta.ca/files/qj72p9692


University of Alberta

25. Javaheri, Ali. A Molecular Dynamics Study of the Dissolution of Asphaltene Model Compounds in Supercritical Fluids.

Degree: MS, Department of Chemical and Materials Engineering, 2010, University of Alberta

 The demand for a new solvent to treat oilsands was behind the purpose of this project; molecular dynamics simulation was used in this study. Supercritical… (more)

Subjects/Keywords: Asphaltene; Supercritical Fluid; Molecular Dynamics

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APA (6th Edition):

Javaheri, A. (2010). A Molecular Dynamics Study of the Dissolution of Asphaltene Model Compounds in Supercritical Fluids. (Masters Thesis). University of Alberta. Retrieved from https://era.library.ualberta.ca/files/gh93gz508

Chicago Manual of Style (16th Edition):

Javaheri, Ali. “A Molecular Dynamics Study of the Dissolution of Asphaltene Model Compounds in Supercritical Fluids.” 2010. Masters Thesis, University of Alberta. Accessed October 23, 2019. https://era.library.ualberta.ca/files/gh93gz508.

MLA Handbook (7th Edition):

Javaheri, Ali. “A Molecular Dynamics Study of the Dissolution of Asphaltene Model Compounds in Supercritical Fluids.” 2010. Web. 23 Oct 2019.

Vancouver:

Javaheri A. A Molecular Dynamics Study of the Dissolution of Asphaltene Model Compounds in Supercritical Fluids. [Internet] [Masters thesis]. University of Alberta; 2010. [cited 2019 Oct 23]. Available from: https://era.library.ualberta.ca/files/gh93gz508.

Council of Science Editors:

Javaheri A. A Molecular Dynamics Study of the Dissolution of Asphaltene Model Compounds in Supercritical Fluids. [Masters Thesis]. University of Alberta; 2010. Available from: https://era.library.ualberta.ca/files/gh93gz508


University of Oxford

26. Craig, Ian R. Ring polymer molecular dynamics.

Degree: 2006, University of Oxford

 This thesis presents the ring polymer molecular dynamics (RPMD) approximation to the Kubo-transformed time correlation function and shows how it may be used as the… (more)

Subjects/Keywords: 547.28; Molecular dynamics : Condensed matter

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APA (6th Edition):

Craig, I. R. (2006). Ring polymer molecular dynamics. (Doctoral Dissertation). University of Oxford. Retrieved from http://ora.ox.ac.uk/objects/uuid:f3c37800-6fc7-4d8b-b135-94d94a7cf4e1 ; http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.432559

Chicago Manual of Style (16th Edition):

Craig, Ian R. “Ring polymer molecular dynamics.” 2006. Doctoral Dissertation, University of Oxford. Accessed October 23, 2019. http://ora.ox.ac.uk/objects/uuid:f3c37800-6fc7-4d8b-b135-94d94a7cf4e1 ; http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.432559.

MLA Handbook (7th Edition):

Craig, Ian R. “Ring polymer molecular dynamics.” 2006. Web. 23 Oct 2019.

Vancouver:

Craig IR. Ring polymer molecular dynamics. [Internet] [Doctoral dissertation]. University of Oxford; 2006. [cited 2019 Oct 23]. Available from: http://ora.ox.ac.uk/objects/uuid:f3c37800-6fc7-4d8b-b135-94d94a7cf4e1 ; http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.432559.

Council of Science Editors:

Craig IR. Ring polymer molecular dynamics. [Doctoral Dissertation]. University of Oxford; 2006. Available from: http://ora.ox.ac.uk/objects/uuid:f3c37800-6fc7-4d8b-b135-94d94a7cf4e1 ; http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.432559


University of Edinburgh

27. Reilly, Anthony M. Experimental equilibrium structures of solids and gases.

Degree: 2009, University of Edinburgh

 In the past sixty years, X-ray, neutron and electron dffraction have emerged as the structural techniques of choice in the solid state. However, despite many… (more)

Subjects/Keywords: 548; diffraction; molecular dynamics; structure

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APA (6th Edition):

Reilly, A. M. (2009). Experimental equilibrium structures of solids and gases. (Doctoral Dissertation). University of Edinburgh. Retrieved from http://hdl.handle.net/1842/3514

Chicago Manual of Style (16th Edition):

Reilly, Anthony M. “Experimental equilibrium structures of solids and gases.” 2009. Doctoral Dissertation, University of Edinburgh. Accessed October 23, 2019. http://hdl.handle.net/1842/3514.

MLA Handbook (7th Edition):

Reilly, Anthony M. “Experimental equilibrium structures of solids and gases.” 2009. Web. 23 Oct 2019.

Vancouver:

Reilly AM. Experimental equilibrium structures of solids and gases. [Internet] [Doctoral dissertation]. University of Edinburgh; 2009. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/1842/3514.

Council of Science Editors:

Reilly AM. Experimental equilibrium structures of solids and gases. [Doctoral Dissertation]. University of Edinburgh; 2009. Available from: http://hdl.handle.net/1842/3514


Cornell University

28. Baker, Kristopher. Improving Atomistic Simulations To Predict Deformation And Fracture .

Degree: 2012, Cornell University

 Atomistic simulations can illuminate detailed mechanisms of brittle and ductile fracture and plasticity. However, there are many limitations to these simulations like short timescales, small… (more)

Subjects/Keywords: Multiscale; Fatigue; Molecular Dynamics

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APA (6th Edition):

Baker, K. (2012). Improving Atomistic Simulations To Predict Deformation And Fracture . (Thesis). Cornell University. Retrieved from http://hdl.handle.net/1813/31080

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):

Baker, Kristopher. “Improving Atomistic Simulations To Predict Deformation And Fracture .” 2012. Thesis, Cornell University. Accessed October 23, 2019. http://hdl.handle.net/1813/31080.

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

MLA Handbook (7th Edition):

Baker, Kristopher. “Improving Atomistic Simulations To Predict Deformation And Fracture .” 2012. Web. 23 Oct 2019.

Vancouver:

Baker K. Improving Atomistic Simulations To Predict Deformation And Fracture . [Internet] [Thesis]. Cornell University; 2012. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/1813/31080.

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

Council of Science Editors:

Baker K. Improving Atomistic Simulations To Predict Deformation And Fracture . [Thesis]. Cornell University; 2012. Available from: http://hdl.handle.net/1813/31080

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


Georgia State University

29. Johnson, Quentin Ramon. An Analysis of Prominent Water Models by Molecular Dynamics Simulations.

Degree: MS, Chemistry, 2010, Georgia State University

 Water is the most common solvent for most biological reactions, therefore it is vital that we fully understand water and all its properties. The complex… (more)

Subjects/Keywords: molecular dynamics; water models

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APA (6th Edition):

Johnson, Q. R. (2010). An Analysis of Prominent Water Models by Molecular Dynamics Simulations. (Thesis). Georgia State University. Retrieved from https://scholarworks.gsu.edu/chemistry_theses/30

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):

Johnson, Quentin Ramon. “An Analysis of Prominent Water Models by Molecular Dynamics Simulations.” 2010. Thesis, Georgia State University. Accessed October 23, 2019. https://scholarworks.gsu.edu/chemistry_theses/30.

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

MLA Handbook (7th Edition):

Johnson, Quentin Ramon. “An Analysis of Prominent Water Models by Molecular Dynamics Simulations.” 2010. Web. 23 Oct 2019.

Vancouver:

Johnson QR. An Analysis of Prominent Water Models by Molecular Dynamics Simulations. [Internet] [Thesis]. Georgia State University; 2010. [cited 2019 Oct 23]. Available from: https://scholarworks.gsu.edu/chemistry_theses/30.

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

Council of Science Editors:

Johnson QR. An Analysis of Prominent Water Models by Molecular Dynamics Simulations. [Thesis]. Georgia State University; 2010. Available from: https://scholarworks.gsu.edu/chemistry_theses/30

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


Oregon State University

30. Bozlee, Brian J. Application of laser spectroscopy to structure and dynamics of small molecular systems.

Degree: PhD, Chemistry, 1986, Oregon State University

 A variety of laser spectroscopic methods are employed in this thesis research for studies of CF₃NO, an interesting model photodissociative system, and for investigation of… (more)

Subjects/Keywords: Molecular dynamics

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APA (6th Edition):

Bozlee, B. J. (1986). Application of laser spectroscopy to structure and dynamics of small molecular systems. (Doctoral Dissertation). Oregon State University. Retrieved from http://hdl.handle.net/1957/40060

Chicago Manual of Style (16th Edition):

Bozlee, Brian J. “Application of laser spectroscopy to structure and dynamics of small molecular systems.” 1986. Doctoral Dissertation, Oregon State University. Accessed October 23, 2019. http://hdl.handle.net/1957/40060.

MLA Handbook (7th Edition):

Bozlee, Brian J. “Application of laser spectroscopy to structure and dynamics of small molecular systems.” 1986. Web. 23 Oct 2019.

Vancouver:

Bozlee BJ. Application of laser spectroscopy to structure and dynamics of small molecular systems. [Internet] [Doctoral dissertation]. Oregon State University; 1986. [cited 2019 Oct 23]. Available from: http://hdl.handle.net/1957/40060.

Council of Science Editors:

Bozlee BJ. Application of laser spectroscopy to structure and dynamics of small molecular systems. [Doctoral Dissertation]. Oregon State University; 1986. Available from: http://hdl.handle.net/1957/40060

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