Retrieve chemical retention indices from NIST with {webchem}!

My PhD has involved learning a lot more than I expected about analytical chemistry, and as I’ve been learning, I’ve been trying my best to make my life easier by writing R functions to help me out. Some of those functions have found a loving home in the webchem package, part of rOpenSci. Papers that use gas chromatography to separate and measure chemicals often include a table of the compounds they found along with experimental retention indices and literature retention indices.

Cupcakes vs. Muffins

One thing I’ve learned from my PhD at Tufts is that I really enjoy working data wrangling, visualization, and statistics in R. I enjoy it so much, that lately I’ve been strongly considering a career in data science after graduation. As a way to showcase my data science skills, I’ve been working on a side project to use webscraping and multivariate statistics to answer the age old question: Are cupcakes really that different from muffins?