[HTML][HTML] Undergraduate structural biology education: A shift from users to developers of computation and simulation tools

AR McDonald, R Roberts, JR Koeppe… - Current Opinion in …, 2022 - Elsevier
The use of theory and simulation in undergraduate education in biochemistry, molecular
biology, and structural biology is now common, but the skills students need and the …

A gentle introduction to machine learning for chemists: An undergraduate workshop using python notebooks for visualization, data processing, analysis, and modeling

D Lafuente, B Cohen, G Fiorini, AA García… - Journal of Chemical …, 2021 - ACS Publications
Machine learning, a subdomain of artificial intelligence, is a widespread technology that is
molding how chemists interact with data. Therefore, it is a relevant skill to incorporate into …

Emerging Areas in Undergraduate Analytical Chemistry Education: Microfluidics, Microcontrollers, and Chemometrics

AM Hupp, ML Kovarik… - Annual Review of …, 2024 - annualreviews.org
Analytical chemistry is a fast-paced field with frequent introduction of new techniques via
research labs; however, incorporation of new techniques into academic curricula lags their …

Whey Protein Analysis Using the Lowry Assay and 96-Well-Plate Digital Images Acquired Using Smartphones

EJ Assink Junior, PC de Jesus… - Journal of Chemical …, 2023 - ACS Publications
Here, students determine the total protein content in whey protein samples using the Lowry
assay. Quantitative analysis was carried out using absorbance measured at 750 nm …

Using Jupyter tools to design an interactive textbook to guide undergraduate research in materials informatics

E Chen, M Asta - 2022 - ACS Publications
With the growing desire to incorporate data science and informatics into STEM curricula,
there is an opportunity to integrate research-based software and tools (eg, Python) within …

Machine learning for functional group identification in vibrational spectroscopy: a pedagogical lab for undergraduate chemistry students

ES Thrall, SE Lee, J Schrier, Y Zhao - Journal of Chemical …, 2021 - ACS Publications
Techniques from the branch of artificial intelligence known as machine learning (ML) have
been applied to a wide range of problems in chemistry. Nonetheless, there are very few …

Open-Source Software Development in Cheminformatics: A Qualitative Analysis of Rationales

J Pernaa, A Takala, V Ciftci, J Hernández-Ramos… - Applied Sciences, 2023 - mdpi.com
Featured Application Cheminformatics is an emerging discipline of chemistry, and software
engineering has a central role in this multidisciplinary research field. The background of …

Article Citation Tracking Exercise: An Activity in Assessing Research Impact and the Interdisciplinary Nature of Chemistry

RL Reyes - Journal of Chemical Education, 2023 - ACS Publications
Primary literature searching and the utility of research articles in chemistry teaching and
instructions provide connections between conceptual understanding and the application of …

Basic cheminformatics course for first-year chemistry students

AS Kadtsyna, AS Chubarov… - Journal of Chemical …, 2022 - ACS Publications
Cheminformatics is a widely used interdisciplinary field that is important for many chemistry
areas. Cheminformatics skills are necessary for dealing with a large amount of chemical …

A spanish chemoinformatics GitBook for chemical data retrieval and analysis using Python programming

FI Saldivar-González, DL Prado-Romero… - 2024 - ACS Publications
Searching, retrieving, and analyzing chemical information are among the main tasks faced
by students and professionals in chemistry-related scientific disciplines. Currently, freely …