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title Smith Group GitHub Pages

R Packages

Methods and software from the Smith Group and others for NMR data analysis and related workflows

r-universe: smith-group

  • fitnmr multidimensional NMR spectrum analysis CRAN version r-universe version

  • deeppicker interface for ANN-based NMR peak picker r-universe version

  • sparseLM interface for Levenberg-Marquardt with sparse Jacobian CRAN version r-universe version

Install stable release versions from CRAN

Install for standard R with:

install.packages("fitnmr", repos = "https://cloud.r-project.org")
install.packages("sparseLM", repos = "https://cloud.r-project.org")

Install latest GitHub versions from R-universe

R

Install for standard R with:

install.packages("fitnmr", repos = c("https://smith-group.r-universe.dev", "https://cloud.r-project.org"))
install.packages("deeppicker", repos = c("https://smith-group.r-universe.dev", "https://cloud.r-project.org"))
install.packages("sparseLM", repos = c("https://smith-group.r-universe.dev", "https://cloud.r-project.org"))

webR

Install webR binaries with:

webr::install("fitnmr", repos = c("https://smith-group.r-universe.dev", "https://repo.r-wasm.org"))
webr::install("deeppicker", repos = c("https://smith-group.r-universe.dev", "https://repo.r-wasm.org"))
webr::install("sparseLM", repos = c("https://smith-group.r-universe.dev", "https://repo.r-wasm.org"))