Physical Sciences and Mathematics Commons^™

The Importance Of Properly Modeling The Hydrogen Bond In Histidine, Falonne M. Tchodimo, Guoquan Zhou, Hua-Jun Fan

Pursue: Undergraduate Research Journal

The hydrogen bond plays a vital role in many reactions. This study is to investigate the effect of different hydrogen bonding modes, such as single and double hydrogen bonds, via the quantum mechanic (QM) methods. Four histidine models (A, B, C, and D) with different numbers of intra-molecular hydrogen bonds were studied. The QM model results indicate that the double hydrogen bond is plausible and has a more stable geometry. However, this study suggests that the data from QM methods require further evaluation with solvation models to produce an even better energy profile.

Pursue Undergraduate Research Journal Volume 2 (Issue 1) 2019

Pursue: Undergraduate Research Journal

The scholarly journal, “PURSUE: Undergraduate Research Journal” (ISSN 2473-6201), provides undergraduates an avenue to publish their original research abstracts and articles in the following areas: psychology, sociology, biology, chemistry, physics, engineering, computer science, mathematics, humanities, agriculture, architecture, health, business, and education (this list is not exclusive).

The original research articles included in this journal are peer reviewed and selected by the journal’s Editorial Board. The review process allows undergraduate researchers to receive feedback from notable scientists in their field of study and teach them about the publication process. Publication of their work will not only inform the scientific community; it …

Spatial Variability Of Manganese Oxide In Two Soilscapes: Upland-Lowland, And Riparian Buffer-Wetland Boundary- Wetland, Benjamin Onweni, Richard Griffin, Robert Thomas, Edward Timms, Javon Polk, Annette James

Pursue: Undergraduate Research Journal

Background: This research project describes the development

of a quantitative measurement methodology to determine the

concentration of manganese oxide (MnOx) in two soilscape

positions (Upland- Lowland and Riparian Buffer-Wetland

Boundary-Wetland). Methods: A reaction between the MnOx

in the soil sample and hydrogen peroxide (H2O2) was initiated

to determine the level of MnOx reactivity in the soil sample. Data

was collected from four sites on Soilscape 1 (Upland, Lowland,

and two sites between the Uplands and Lowlands); within each

site, five soil profile depths and three sample replicates were

measured which comprised a total of 60 samples. Additionally,

data was collected …