************************************************************************* *** ANATOLIA *** *** Program for total lineshape analysis *** *** of NMR spectra *** ************************************************************************* *** (C) 2017 Dmitry Cheshkov, Dmitry Sinitsyn, *** *** Kirill Sheberstov *** ************************************************************************* *** dcheshkov@gmail.com *** *** http://anatolia.nmrclub.ru *** *** https://github.com/dcheshkov/ANATOLIA *** ************************************************************************* *** D.A. Cheshkov, K.F. Sheberstov, D.O. Sinitsyn, V.A. Chertkov, *** *** ANATOLIA: NMR software for spectral analysis of total lineshape, *** *** Magn. Reson. Chem., 2018, 56, 449, DOI: 10.1002/mrc.4689. *** ************************************************************************* Working with Bruker NMR format (dataset) only. Can be run in standalone mode or via AU programm 'anatolia' from Bruker TopSpin. When using with TopSpin it should be located in TopSpinHome/prog/anatolia directory. Versions for ALL platforms compiled and linked in 'static' mode, so they are a distributed as single executable files. All source code currently located in single c++ file 'anatolia.cpp'. For matrix diagonalization it utilizes procedures from GNU scientific library (https://www.gnu.org/software/gsl/). Powell's BOBYQA algoritm used for multidimentional function minimization. ANATOLIA reads the input files from current directory, when called without arguments, or can take path to working directory as command line argument.