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authorJohannes Ranke <johannes.ranke@jrwb.de>2025-02-16 17:27:18 +0100
committerJohannes Ranke <johannes.ranke@jrwb.de>2025-02-16 17:29:28 +0100
commit4f62f39b8979cb3a5c52d65d425e530dc0770665 (patch)
tree895d4bde0773a600943e5c308e17651c12358a67 /log
parent44c30938872bd7cc80a4c84dd4db593e26000fce (diff)
Fix solution type "deSolve" for a special caseHEADdev
The special case occurs if not observed data for time zero are available. Fixes #16. Write NEWS and update docs. A lot of html was regenerated, because I had checked out the main branch in between, which made pkgdown believe that I have changed the help files.
Diffstat (limited to 'log')
-rw-r--r--log/build.log2
-rw-r--r--log/test.log27
2 files changed, 15 insertions, 14 deletions
diff --git a/log/build.log b/log/build.log
index de7e4488..c39714cb 100644
--- a/log/build.log
+++ b/log/build.log
@@ -7,5 +7,5 @@
* checking for empty or unneeded directories
Removed empty directory ‘mkin/inst/rmarkdown/templates/hierarchical_kinetics_parent’
Removed empty directory ‘mkin/vignettes/web_only’
-* building ‘mkin_1.2.9.tar.gz’
+* building ‘mkin_1.2.10.tar.gz’
diff --git a/log/test.log b/log/test.log
index 746f0458..f475b7d5 100644
--- a/log/test.log
+++ b/log/test.log
@@ -1,29 +1,30 @@
ℹ Testing mkin
✔ | F W S OK | Context
✔ | 5 | AIC calculation
-✔ | 5 | Analytical solutions for coupled models [1.6s]
+✔ | 5 | Analytical solutions for coupled models [1.5s]
✔ | 5 | Calculation of Akaike weights
✔ | 3 | Export dataset for reading into CAKE
-✔ | 6 | Use of precompiled symbols in mkinpredict [3.3s]
+✔ | 6 | Use of precompiled symbols in mkinpredict [3.2s]
✔ | 12 | Confidence intervals and p-values
-✔ | 1 12 | Dimethenamid data from 2018 [13.3s]
-✔ | 14 | Error model fitting [2.7s]
+✔ | 1 | Solutions with deSolve
+✔ | 1 12 | Dimethenamid data from 2018 [13.1s]
+✔ | 14 | Error model fitting [2.5s]
✔ | 5 | Time step normalisation
✔ | 4 | Calculation of FOCUS chi2 error levels
✔ | 14 | Results for FOCUS D established in expertise for UBA (Ranke 2014)
✔ | 4 | Test fitting the decline of metabolites from their maximum
✔ | 1 | Fitting the logistic model
-✔ | 10 | Batch fitting and diagnosing hierarchical kinetic models [19.7s]
-✔ | 2 16 | Nonlinear mixed-effects models [148.2s]
+✔ | 10 | Batch fitting and diagnosing hierarchical kinetic models [19.6s]
+✔ | 2 16 | Nonlinear mixed-effects models [145.0s]
✔ | 3 | Test dataset classes mkinds and mkindsg
✔ | 10 | Special cases of mkinfit calls
✔ | 3 | mkinfit features
✔ | 8 | mkinmod model generation and printing
-✔ | 3 | Model predictions with mkinpredict
-✔ | 12 | Multistart method for saem.mmkin models [23.7s]
-✔ | 16 | Evaluations according to 2015 NAFTA guidance [1.6s]
-✔ | 9 | Nonlinear mixed-effects models with nlme [4.2s]
-✔ | 15 | Plotting [4.6s]
+✔ | 4 | Model predictions with mkinpredict
+✔ | 12 | Multistart method for saem.mmkin models [22.9s]
+✔ | 16 | Evaluations according to 2015 NAFTA guidance [1.8s]
+✔ | 9 | Nonlinear mixed-effects models with nlme [4.0s]
+✔ | 15 | Plotting [4.7s]
✔ | 4 | Residuals extracted from mkinfit models
✔ | 1 38 | saemix parent models [35.9s]
✔ | 2 | Complex test case from Schaefer et al. (2007) Piacenza paper
@@ -37,7 +38,7 @@
✔ | 2 | water-sediment
══ Results ═════════════════════════════════════════════════════════════════════
-Duration: 268.8 s
+Duration: 264.5 s
── Skipped tests (4) ───────────────────────────────────────────────────────────
• Fitting this ODE model with saemix takes about 5 minutes on my new system
@@ -48,4 +49,4 @@ Duration: 268.8 s
• This still takes almost 2.5 minutes although we do not solve ODEs (1):
'test_saemix_parent.R:143:3'
-[ FAIL 0 | WARN 0 | SKIP 4 | PASS 285 ]
+[ FAIL 0 | WARN 0 | SKIP 4 | PASS 287 ]

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