From 7624a2b8398b4ad665a3b0b622488e1893a5ee7c Mon Sep 17 00:00:00 2001 From: Johannes Ranke Date: Mon, 21 Oct 2019 12:11:34 +0200 Subject: Refactor mkinfit, infrastructure work mkinfit objects now include an ll() function to calculate the log-likelihood. Part of the code was refactored, hopefully making it easier to read and maintain. IRLS is currently the default algorithm for the error model "obs", for no particular reason. This may be subject to change when I get around to investigate. Slow tests are now in a separate subdirectory and will probably only be run by my own Makefile target. Formatting of test logs is improved. Roundtripping error model parameters works with a precision of 10% when we use lots of replicates in the synthetic data (see slow tests). This is not new in this commit, but as I think it is reasonable this closes #7. --- DESCRIPTION | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) (limited to 'DESCRIPTION') diff --git a/DESCRIPTION b/DESCRIPTION index bc8e61d6..9efa2b89 100644 --- a/DESCRIPTION +++ b/DESCRIPTION @@ -2,7 +2,7 @@ Package: mkin Type: Package Title: Kinetic Evaluation of Chemical Degradation Data Version: 0.9.49.6 -Date: 2019-09-02 +Date: 2019-10-19 Authors@R: c(person("Johannes", "Ranke", role = c("aut", "cre", "cph"), email = "jranke@uni-bremen.de", comment = c(ORCID = "0000-0003-4371-6538")), -- cgit v1.2.1