%global __brp_check_rpaths %{nil} %global __requires_exclude ^libmpi %global packname biocharkitgui %global packver 0.3.1 %global rlibdir /usr/local/lib/R/library Name: R-CRAN-%{packname} Version: 0.3.1 Release: 1%{?dist}%{?buildtag} Summary: 'Shiny' GUI for the 'biocharkit' Biochar Analysis Toolkit License: MIT + file LICENSE URL: https://cran.r-project.org/package=%{packname} Source0: %{url}&version=%{packver}#/%{packname}_%{packver}.tar.gz BuildRequires: R-devel >= 4.0 Requires: R-core >= 4.0 BuildArch: noarch BuildRequires: R-CRAN-biocharkit >= 0.3.0 BuildRequires: R-CRAN-shiny BuildRequires: R-CRAN-readxl BuildRequires: R-CRAN-DT BuildRequires: R-CRAN-rmarkdown BuildRequires: R-utils Requires: R-CRAN-biocharkit >= 0.3.0 Requires: R-CRAN-shiny Requires: R-CRAN-readxl Requires: R-CRAN-DT Requires: R-CRAN-rmarkdown Requires: R-utils %description A point-and-click 'Shiny' interface to the 'biocharkit' package. Lets a user upload Excel workbooks of biochar characterisation and batch adsorption data, map spreadsheet columns to the required variables via dropdown menus, and run sample-ID parsing, adsorption capacity and removal efficiency calculations, isotherm fitting (Langmuir, Freundlich, Temkin, Dubinin-Radushkevich, Sips), kinetics fitting (pseudo-first/ second-order, Elovich, intraparticle diffusion), van't Hoff thermodynamics, batch fitting across many samples at once, FTIR baseline correction, automatic peak picking and functional-group analysis, XRD peak deconvolution and crystallinity index, BET surface area, TGA analysis (DTG curve with auto-detected decomposition peaks, moisture/volatile-matter/ash/fixed-carbon straight off a curve for a single sample or in batch across many, and Kissinger non-isothermal kinetics from multi-heating-rate data), proximate/ultimate analysis, and correlation matrices, without writing any R code. Results and 600 dpi TIFF figures can be downloaded directly from the browser, along with a combined analysis report. %prep %setup -q -c -n %{packname} # fix end of executable files find -type f -executable -exec grep -Iq . {} \; -exec sed -i -e '$a\' {} \; # prevent binary stripping [ -d %{packname}/src ] && find %{packname}/src -type f -exec \ sed -i 's@/usr/bin/strip@/usr/bin/true@g' {} \; || true [ -d %{packname}/src ] && find %{packname}/src/Make* -type f -exec \ sed -i 's@-g0@@g' {} \; || true # don't allow local prefix in executable scripts find -type f -executable -exec sed -Ei 's@#!( )*/usr/local/bin@#!/usr/bin@g' {} \; %build %install mkdir -p %{buildroot}%{rlibdir} %{_bindir}/R CMD INSTALL -l %{buildroot}%{rlibdir} %{packname} test -d %{packname}/src && (cd %{packname}/src; rm -f *.o *.so) rm -f %{buildroot}%{rlibdir}/R.css # remove buildroot from installed files find %{buildroot}%{rlibdir} -type f -exec sed -i "s@%{buildroot}@@g" {} \; %files %{rlibdir}/%{packname}