mkin/data, branch v0.9.42 Fitting kinetic models to chemical degradation data (also on github) https://cgit.jrwb.de/mkin/atom?h=v0.9.42 2015-05-15T11:04:36Z Add synthetic data generated for UBA expertise, tests 2015-05-15T11:04:36Z Johannes Ranke jranke@uni-bremen.de 2015-05-15T11:04:36Z urn:sha1:9a5d2378845e584a2a2c6c09f7ef99a82d09273b The new tests are based on the results documented in the expertise I wrote for the UBA (currently unpublished). Fork the GUI into package gmkin. See ChangeLog for details 2014-05-07T13:01:50Z Johannes Ranke jranke@uni-bremen.de 2014-05-07T13:01:50Z urn:sha1:34452dfa5c069dc0f0a58681a35719fbb8cca158 Update of FOCUS 2006 Z workspace with current mkinfit 2014-04-30T14:14:20Z Johannes Ranke jranke@uni-bremen.de 2014-04-30T14:14:20Z urn:sha1:d0a3218ba20a5f2699cacb5920e82b4d64eb8db5 Reformat McCall data to have one Rd file per object 2014-04-29T15:06:47Z Johannes Ranke jranke@uni-bremen.de 2014-04-29T15:06:47Z urn:sha1:6ac5441b02f6efebb3e6df81559c818b36841521 Revert to percent sign "%" in FOCUS 2006 data 2014-04-28T19:45:32Z Johannes Ranke jranke@uni-bremen.de 2014-04-28T19:45:32Z urn:sha1:de7de65fc97ae54c731b829c13d01fc065b0b15d Fix the name of the R object 2014-04-28T16:40:11Z Johannes Ranke jranke@uni-bremen.de 2014-04-28T16:40:11Z urn:sha1:436b1b533445bb1d73d01d76b02ffc2933712e2c Avoid percent sign and add a fit to avoid errors 2014-04-28T15:58:01Z Johannes Ranke jranke@uni-bremen.de 2014-04-28T15:58:01Z urn:sha1:f217301d19c9297b3ae3a1b215c8d573cda4c2e5 McCall 2,4,5-T dataset, lower bound for transform_rates=FALSE 2014-04-25T16:43:51Z Johannes Ranke jranke@uni-bremen.de 2014-04-25T16:43:51Z urn:sha1:59e2c3b5ce470ace53b93ad5e6e7d9acbfe86f21 Format of gmkin workspace files, copyright, updates 2014-02-27T15:36:11Z Johannes Ranke jranke@uni-bremen.de 2014-02-27T15:36:11Z urn:sha1:6910e67398dbcb548dae179d361cb24404ad75a4 - Change the format of the workspace files of gmkin so they can be distributed in the mkin package - Add gmkin workspace datasets FOCUS_2006_gmkin and FOCUS_2006_Z_gmkin - Restrict the unit test with the Schaefer data to parent and primary metabolites as formation fraction and DT50 for A2 are higly correlated and passing the test is platform dependent. For example, the test fails in 1 out of 14 platforms on CRAN as of today - Add Eurofins Regulatory AG copyright notices - Import FME and deSolve instead of depending on them to have cleaner startup - Added the reference fit data for FOCUS 2006 datasets from the kinfit package 2012-04-24T17:33:56Z jranke jranke@edb9625f-4e0d-4859-8d74-9fd3b1da38cb 2012-04-24T17:33:56Z urn:sha1:081b5f25cc4ef779175307d9ce20672e0573b7c9 - Used these data in unit tests for parent only models - Fixed SFORB data and calculation of formation fractions along the way - Reintroduced the test for the Schaefer 2007 data - Got rid of the mkinmod unit tests - they are too hard to maintain and the mkinfit tests test the model definitions as well git-svn-id: svn+ssh://svn.r-forge.r-project.org/svnroot/kinfit/pkg/mkin@32 edb9625f-4e0d-4859-8d74-9fd3b1da38cb