Engineering Commons^™

A Preliminary Comparative Study Of Molecular Visualization Software For Education, Ruoming Shen

Modeling, Simulation and Visualization Student Capstone Conference

Chemistry and biology are sciences vital for understanding metabolic processes, developing disease treatments, and improving environmental conditions. With extensive knowledge of biochemistry, we can take advantage of a material’s unique chemical composition and properties in various applications. Visualization software is essential for analyzing complex chemical and biological structures and predicting their interactions with each other. This paper presents a preliminary study of three open source molecular visualization software tools - Visual Molecular Dynamics (VMD), Jmol, and Mol*, and evaluates their strengths and deficiencies. This paper utilizes the March Molecule of the Month, Vascular Endothelial Growth Factor (VEGF), from the Protein …

Feco2o4 As An Anode Material For Lithium Ion Batteries, Chelsea Wong

The International Student Science Fair 2018

Lithium ion batteries (LIBs) are commonly found in many portable electronic appliances due to their ability to be rechargeable. Currently, commercial anodes in Li-ion batteries (graphite) have a theoretical capacity of around 372 mAh/g, while FeCo2O4 that will be investigated as the anode material has a theoretical capacity of 901.985mAh/g, more than double of the current commercial anode’s capacity. Earlier work done by Sharma et al also showed that FeCo2O4 has a very promising initial capacity of 827mAh/g. As such, the engineering goal is to produce a battery that will have a higher capacity than the current commercial Li-ion batteries …

Glucosamine From Hydrolysis Of 3d Printing Chitosan For Osteoarthritis Treatment, Ruj Dansriboon, Laphon Premcharoen

The International Student Science Fair 2018

This project aims to introduce a new way for osteoarthritis treatment which is expected to increase in the future. Glucosamine is the main subject for a treatment, which can be derived by hydrolyzing chitosan. This project also includes extraction of chitosan from shrimp waste to make a worthy use of food waste from industry. In this project, 3D printer is applied to print chitosan gel since 3D printing is adjustable to form various shapes of the gel.

The research process begins with the extraction of chitosan from shrimp shells. For the next step, the percent of deacetylation of chitosan was …

An Entirely New Molecular Glue For Mof Using Unusual Structural Transformation Of A Coordination Polymer, Sukwoo Jung, Hangyeol Kim, Junseok Ahn

The International Student Science Fair 2018

In this research, an entirely new molecular glue is reported. This ‘coordination polymer glue’ is synthesized from zinc metal and BDC-NPE(2,5-bis{4-[1-(4-nitrophenyl)ethylamino]butoxy}terephthalic acid). Molecular glue transforms from 1D coordination polymer to a 3D cross-linked framework, resulting in a phase change of solution to solid. The carboxylate group of this glue makes the preformed MOF bind to its framework. Therefore, when the solution of molecular glue is mixed with preformed MOF powder and heated, homogeneous and thin MOF film – MOF/ZnNPE film – is fabricated. The film is irrelevant to the kind of its substrate, and its thermal stability was enhanced in …

Modelling Catalytic Structures With Python And Ase, Tommie L. Day, Peilin Liao, Pilsun Yoo

The Summer Undergraduate Research Fellowship (SURF) Symposium

Voltaic cells hold great potential as a source of clean electricity generation. These fuel sources are more efficient than combustion engines, and they do not produce environmentally harmful by-products. The electrochemical reaction which occurs within the cell is typically catalyzed by platinum, which increases the cost. The search for a better performing, less expensive catalyst is hindered by the lack of a complete, predictive theory of catalysis. Using Quantum Espresso and the Atomic Simulation Environment library for Python, we created a tool for nanoHUB.org which can visually and computationally model catalytic surfaces. This tool can simulate nanoparticles and metallic surfaces …

07. Criminal Justice, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

04. Botany, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

06. Computer Science, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

03. Biology, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

08. Engineering, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

10. Forensic Science, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

11. Genetics, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

14. Optometry, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

16. Physics, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

17. Psychology, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

13. Mathematics, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

18. Statistics, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

02. Animal Science, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

05. Chemistry, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

09. Environmental Science, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

12. Kinesiology, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

15. Pharmacy, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.

19. Zoology, Northeastern State University

Oklahoma Research Day Abstracts

No abstract provided.