tag:joss.theoj.org,2005:/papers/tagged/spectral%20processingJournal of Open Source Software2022-04-12T18:05:07ZJournal of Open Source Softwarehttps://joss.theoj.orgtag:joss.theoj.org,2005:Paper/33182022-04-12T18:05:07Z2022-04-13T00:01:12Ztesliper: a theoretical spectroscopist's little helperaccepted0.9.02022-02-02 15:18:26 UTC722022-04-12 18:05:07 UTC720224164MichałM.WięcławInstitute of Organic Chemistry, Polish Academy of Sciences0000-0001-7884-898210.21105/joss.04164https://doi.org/10.5281/zenodo.6448370Pythonhttps://joss.theoj.org/papers/10.21105/joss.04164.pdfchemistry, spectroscopy, Gaussian, chemical computing, optical spectroscopy, spectral simulations, workflow automation, batch processingtag:joss.theoj.org,2005:Paper/19982021-09-10T07:26:03Z2021-09-11T00:03:07ZsubMALDI: an open framework R package for processing irregularly-spaced mass spectrometry dataacceptedv1.0.02020-08-31 01:20:09 UTC652021-09-10 07:26:03 UTC620212694KristenYehForensic Science Program, Trent University0000-0002-3411-6816SophieCastelFaculty of Science, Mathematics, Trent University0000-0001-9086-0917NaomiL.StockWater Quality Center, Trent University0000-0002-3472-9284TheresaStotesburyFaculty of Science, Forensic Science & Applied Bioscience, Ontario Tech University0000-0001-6452-4389WesleyBurrFaculty of Science, Mathematics, Trent University0000-0002-2058-189910.21105/joss.02694https://doi.org/10.5281/zenodo.5498242Rhttps://joss.theoj.org/papers/10.21105/joss.02694.pdfmass spectrometry, spectral processing, MALDI-MS