From dd65f3503e9d091c82aedcf91635fcf40f778bf9 Mon Sep 17 00:00:00 2001 From: Johannes Ranke Date: Fri, 14 Sep 2018 06:41:44 +0200 Subject: Static documentation rebuilt by pkgdown Also update test log --- docs/reference/DFOP.solution.html | 2 +- docs/reference/Extract.mmkin.html | 16 ++++++++-------- docs/reference/FOCUS_2006_DFOP_ref_A_to_B.html | 2 +- docs/reference/FOCUS_2006_FOMC_ref_A_to_F.html | 2 +- docs/reference/FOCUS_2006_HS_ref_A_to_F.html | 2 +- docs/reference/FOCUS_2006_SFO_ref_A_to_F.html | 2 +- docs/reference/FOCUS_2006_datasets.html | 2 +- docs/reference/FOMC.solution.html | 2 +- docs/reference/HS.solution.html | 2 +- docs/reference/IORE.solution.html | 2 +- docs/reference/SFO.solution.html | 2 +- docs/reference/SFORB.solution.html | 2 +- docs/reference/add_err.html | 2 +- docs/reference/endpoints.html | 2 +- docs/reference/geometric_mean.html | 2 +- docs/reference/ilr.html | 2 +- docs/reference/index.html | 2 +- docs/reference/max_twa_parent.html | 2 +- docs/reference/mccall81_245T.html | 10 +++++----- docs/reference/mkin_long_to_wide.html | 2 +- docs/reference/mkin_wide_to_long.html | 2 +- docs/reference/mkinds.html | 2 +- docs/reference/mkinerrmin.html | 2 +- docs/reference/mkinfit.html | 17 +++++++++-------- docs/reference/mkinmod.html | 2 +- docs/reference/mkinparplot.html | 2 +- docs/reference/mkinplot.html | 2 +- docs/reference/mkinpredict.html | 8 ++++---- docs/reference/mkinresplot.html | 2 +- docs/reference/mkinsub.html | 2 +- docs/reference/mmkin.html | 2 +- docs/reference/plot.mkinfit.html | 2 +- docs/reference/plot.mmkin.html | 2 +- docs/reference/print.mkinds.html | 2 +- docs/reference/print.mkinmod.html | 2 +- docs/reference/schaefer07_complex_case.html | 2 +- docs/reference/sigma_twocomp.html | 2 +- docs/reference/summary.mkinfit.html | 10 +++++----- docs/reference/synthetic_data_for_UBA.html | 2 +- docs/reference/test_data_from_UBA_2014.html | 2 +- docs/reference/transform_odeparms.html | 10 +++++----- 41 files changed, 71 insertions(+), 70 deletions(-) (limited to 'docs/reference') diff --git a/docs/reference/DFOP.solution.html b/docs/reference/DFOP.solution.html index c1177306..22709123 100644 --- a/docs/reference/DFOP.solution.html +++ b/docs/reference/DFOP.solution.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/Extract.mmkin.html b/docs/reference/Extract.mmkin.html index 8771b53b..94c4d336 100644 --- a/docs/reference/Extract.mmkin.html +++ b/docs/reference/Extract.mmkin.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 @@ -278,7 +278,7 @@ #> #> $time #> User System verstrichen -#> 0.171 0.001 0.171 +#> 0.165 0.000 0.165 #> #> $mkinmod #> <mkinmod> model generated with @@ -467,8 +467,8 @@ #> } #> return(mC) #> } -#> <bytecode: 0x55555bd7f970> -#> <environment: 0x55555bc8fca8> +#> <bytecode: 0x55555bd36378> +#> <environment: 0x55555bd42bc8> #> #> $cost_notrans #> function (P) @@ -490,8 +490,8 @@ #> scaleVar = scaleVar) #> return(mC) #> } -#> <bytecode: 0x55555ca84338> -#> <environment: 0x55555bc8fca8> +#> <bytecode: 0x55555c995188> +#> <environment: 0x55555bd42bc8> #> #> $hessian_notrans #> parent_0 k_parent_sink @@ -558,10 +558,10 @@ #> 99.17407 #> #> $date -#> [1] "Thu Sep 6 13:35:24 2018" +#> [1] "Fri Sep 14 06:38:57 2018" #> #> $version -#> [1] "0.9.47.2" +#> [1] "0.9.47.3" #> #> $Rversion #> [1] "3.5.1" diff --git a/docs/reference/FOCUS_2006_DFOP_ref_A_to_B.html b/docs/reference/FOCUS_2006_DFOP_ref_A_to_B.html index 6888c0ba..2b6886ff 100644 --- a/docs/reference/FOCUS_2006_DFOP_ref_A_to_B.html +++ b/docs/reference/FOCUS_2006_DFOP_ref_A_to_B.html @@ -65,7 +65,7 @@ in this fit." /> mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/FOCUS_2006_FOMC_ref_A_to_F.html b/docs/reference/FOCUS_2006_FOMC_ref_A_to_F.html index 624f3908..73b2450b 100644 --- a/docs/reference/FOCUS_2006_FOMC_ref_A_to_F.html +++ b/docs/reference/FOCUS_2006_FOMC_ref_A_to_F.html @@ -65,7 +65,7 @@ in this fit." /> mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/FOCUS_2006_HS_ref_A_to_F.html b/docs/reference/FOCUS_2006_HS_ref_A_to_F.html index c089e5e7..e5621863 100644 --- a/docs/reference/FOCUS_2006_HS_ref_A_to_F.html +++ b/docs/reference/FOCUS_2006_HS_ref_A_to_F.html @@ -65,7 +65,7 @@ in this fit." /> mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/FOCUS_2006_SFO_ref_A_to_F.html b/docs/reference/FOCUS_2006_SFO_ref_A_to_F.html index e6846a38..872d68a9 100644 --- a/docs/reference/FOCUS_2006_SFO_ref_A_to_F.html +++ b/docs/reference/FOCUS_2006_SFO_ref_A_to_F.html @@ -65,7 +65,7 @@ in this fit." /> mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/FOCUS_2006_datasets.html b/docs/reference/FOCUS_2006_datasets.html index 42ff6926..232be6f3 100644 --- a/docs/reference/FOCUS_2006_datasets.html +++ b/docs/reference/FOCUS_2006_datasets.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/FOMC.solution.html b/docs/reference/FOMC.solution.html index 9f7db6c1..c4f3158d 100644 --- a/docs/reference/FOMC.solution.html +++ b/docs/reference/FOMC.solution.html @@ -65,7 +65,7 @@ The form given here differs slightly from the original reference by Gustafson mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/HS.solution.html b/docs/reference/HS.solution.html index 87ee2d20..8f1ff8de 100644 --- a/docs/reference/HS.solution.html +++ b/docs/reference/HS.solution.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/IORE.solution.html b/docs/reference/IORE.solution.html index 18c8a751..ae09fcf7 100644 --- a/docs/reference/IORE.solution.html +++ b/docs/reference/IORE.solution.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/SFO.solution.html b/docs/reference/SFO.solution.html index ac26f950..f4e8eb42 100644 --- a/docs/reference/SFO.solution.html +++ b/docs/reference/SFO.solution.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/SFORB.solution.html b/docs/reference/SFORB.solution.html index bb782104..e568bd5a 100644 --- a/docs/reference/SFORB.solution.html +++ b/docs/reference/SFORB.solution.html @@ -65,7 +65,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/add_err.html b/docs/reference/add_err.html index 9d71c18c..99871884 100644 --- a/docs/reference/add_err.html +++ b/docs/reference/add_err.html @@ -63,7 +63,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/endpoints.html b/docs/reference/endpoints.html index 46cb10e1..e39d1c15 100644 --- a/docs/reference/endpoints.html +++ b/docs/reference/endpoints.html @@ -64,7 +64,7 @@ with the advantage that the SFORB model can also be used for metabolites." /> mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/geometric_mean.html b/docs/reference/geometric_mean.html index 091e65ea..a5c63aeb 100644 --- a/docs/reference/geometric_mean.html +++ b/docs/reference/geometric_mean.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/ilr.html b/docs/reference/ilr.html index 34edfc08..ec49468a 100644 --- a/docs/reference/ilr.html +++ b/docs/reference/ilr.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/index.html b/docs/reference/index.html index d9705ce3..af7642e6 100644 --- a/docs/reference/index.html +++ b/docs/reference/index.html @@ -58,7 +58,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/max_twa_parent.html b/docs/reference/max_twa_parent.html index 447d9fda..8d31b0d2 100644 --- a/docs/reference/max_twa_parent.html +++ b/docs/reference/max_twa_parent.html @@ -65,7 +65,7 @@ guidance." /> mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/mccall81_245T.html b/docs/reference/mccall81_245T.html index 9894f8eb..cea92155 100644 --- a/docs/reference/mccall81_245T.html +++ b/docs/reference/mccall81_245T.html @@ -63,7 +63,7 @@ mkin - 0.9.47.2 + 0.9.47.3 @@ -164,10 +164,10 @@ fit.2 <- mkinfit(SFO_SFO_SFO, subset(mccall81_245T, soil == "Commerce"), parms.ini = c(k_phenol_sink = 0), fixed_parms = "k_phenol_sink", quiet = TRUE) - summary(fit.2, data = FALSE)
#> mkin version used for fitting: 0.9.47.2 + summary(fit.2, data = FALSE)
#> mkin version used for fitting: 0.9.47.3 #> R version used for fitting: 3.5.1 -#> Date of fit: Thu Sep 6 13:35:34 2018 -#> Date of summary: Thu Sep 6 13:35:34 2018 +#> Date of fit: Fri Sep 14 06:39:07 2018 +#> Date of summary: Fri Sep 14 06:39:07 2018 #> #> Equations: #> d_T245/dt = - k_T245_sink * T245 - k_T245_phenol * T245 @@ -177,7 +177,7 @@ #> #> Model predictions using solution type deSolve #> -#> Fitted with method Port using 246 model solutions performed in 1.549 s +#> Fitted with method Port using 246 model solutions performed in 1.423 s #> #> Weighting: none #> diff --git a/docs/reference/mkin_long_to_wide.html b/docs/reference/mkin_long_to_wide.html index 2bf67d39..8d53bc1b 100644 --- a/docs/reference/mkin_long_to_wide.html +++ b/docs/reference/mkin_long_to_wide.html @@ -63,7 +63,7 @@ mkin - 0.9.47.2 + 0.9.47.3
diff --git a/docs/reference/mkin_wide_to_long.html b/docs/reference/mkin_wide_to_long.html index 3e0f10f7..e7342cee 100644 --- a/docs/reference/mkin_wide_to_long.html +++ b/docs/reference/mkin_wide_to_long.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/mkinds.html b/docs/reference/mkinds.html index 3f4a84ec..16086f3e 100644 --- a/docs/reference/mkinds.html +++ b/docs/reference/mkinds.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/mkinerrmin.html b/docs/reference/mkinerrmin.html index 44fc1e51..c8fd8272 100644 --- a/docs/reference/mkinerrmin.html +++ b/docs/reference/mkinerrmin.html @@ -62,7 +62,7 @@ chi-squared test as defined in the FOCUS kinetics report from 2006." /> mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/mkinfit.html b/docs/reference/mkinfit.html index f9c6c117..b1c42168 100644 --- a/docs/reference/mkinfit.html +++ b/docs/reference/mkinfit.html @@ -71,7 +71,7 @@ mkin - 0.9.47.2 + 0.9.47.3 @@ -161,7 +161,7 @@ transform_rates = TRUE, transform_fractions = TRUE, plot = FALSE, quiet = FALSE, err = NULL, - weight = c("none", "std", "mean", "tc"), + weight = c("none", "manual", "std", "mean", "tc"), tc = c(sigma_low = 0.5, rsd_high = 0.07), scaleVar = FALSE, atol = 1e-8, rtol = 1e-10, n.outtimes = 100, @@ -326,7 +326,8 @@ weight

only if err=NULL: how to weight the residuals, one of "none", "std", "mean", see details of modCost, or "tc" for the - two component error model.

+ two component error model. The option "manual" is available for + the case that err!=NULL, but it is not necessary to specify it.

tc @@ -431,17 +432,17 @@

Examples

# Use shorthand notation for parent only degradation fit <- mkinfit("FOMC", FOCUS_2006_C, quiet = TRUE) -summary(fit)
#> mkin version used for fitting: 0.9.47.2 +summary(fit)
#> mkin version used for fitting: 0.9.47.3 #> R version used for fitting: 3.5.1 -#> Date of fit: Thu Sep 6 13:35:36 2018 -#> Date of summary: Thu Sep 6 13:35:36 2018 +#> Date of fit: Fri Sep 14 06:39:09 2018 +#> Date of summary: Fri Sep 14 06:39:09 2018 #> #> Equations: #> d_parent/dt = - (alpha/beta) * 1/((time/beta) + 1) * parent #> #> Model predictions using solution type analytical #> -#> Fitted with method Port using 64 model solutions performed in 0.144 s +#> Fitted with method Port using 64 model solutions performed in 0.157 s #> #> Weighting: none #> @@ -510,7 +511,7 @@ m1 = mkinsub("SFO"))
#> Successfully compiled differential equation model from auto-generated C code.
# Fit the model to the FOCUS example dataset D using defaults print(system.time(fit <- mkinfit(SFO_SFO, FOCUS_2006_D, solution_type = "eigen", quiet = TRUE)))
#> User System verstrichen -#> 0.919 0.000 0.920
coef(fit)
#> parent_0 log_k_parent_sink log_k_parent_m1 log_k_m1_sink +#> 0.892 0.000 0.892
coef(fit)
#> parent_0 log_k_parent_sink log_k_parent_m1 log_k_m1_sink #> 99.59848 -3.03822 -2.98030 -5.24750
#> $ff #> parent_sink parent_m1 m1_sink #> 0.485524 0.514476 1.000000 diff --git a/docs/reference/mkinmod.html b/docs/reference/mkinmod.html index a9c6bb26..a0eade3b 100644 --- a/docs/reference/mkinmod.html +++ b/docs/reference/mkinmod.html @@ -66,7 +66,7 @@ For the definition of model types and their parameters, the equations given mkin - 0.9.47.2 + 0.9.47.3
diff --git a/docs/reference/mkinparplot.html b/docs/reference/mkinparplot.html index 33eeefbd..75d22288 100644 --- a/docs/reference/mkinparplot.html +++ b/docs/reference/mkinparplot.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/mkinplot.html b/docs/reference/mkinplot.html index 71437181..6aa67e5b 100644 --- a/docs/reference/mkinplot.html +++ b/docs/reference/mkinplot.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/mkinpredict.html b/docs/reference/mkinpredict.html index 59b67a5d..6c2ba992 100644 --- a/docs/reference/mkinpredict.html +++ b/docs/reference/mkinpredict.html @@ -63,7 +63,7 @@ mkin - 0.9.47.2 + 0.9.47.3 @@ -321,17 +321,17 @@ c(parent = 100, m1 = 0), seq(0, 20, by = 0.1), solution_type = "eigen")[201,]))
#> time parent m1 #> 201 20 4.978707 27.46227
#> User System verstrichen -#> 0.003 0.000 0.003
system.time( +#> 0.004 0.000 0.003
system.time( print(mkinpredict(SFO_SFO, c(k_parent_m1 = 0.05, k_parent_sink = 0.1, k_m1_sink = 0.01), c(parent = 100, m1 = 0), seq(0, 20, by = 0.1), solution_type = "deSolve")[201,]))
#> time parent m1 #> 201 20 4.978707 27.46227
#> User System verstrichen -#> 0.002 0.000 0.002
system.time( +#> 0.001 0.000 0.002
system.time( print(mkinpredict(SFO_SFO, c(k_parent_m1 = 0.05, k_parent_sink = 0.1, k_m1_sink = 0.01), c(parent = 100, m1 = 0), seq(0, 20, by = 0.1), solution_type = "deSolve", use_compiled = FALSE)[201,]))
#> time parent m1 #> 201 20 4.978707 27.46227
#> User System verstrichen -#> 0.037 0.000 0.038
+#> 0.035 0.000 0.036 diff --git a/docs/reference/mkinsub.html b/docs/reference/mkinsub.html index 85345135..65de0664 100644 --- a/docs/reference/mkinsub.html +++ b/docs/reference/mkinsub.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/mmkin.html b/docs/reference/mmkin.html index 2a060628..557da0d7 100644 --- a/docs/reference/mmkin.html +++ b/docs/reference/mmkin.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/plot.mkinfit.html b/docs/reference/plot.mkinfit.html index 07fc4854..765f1628 100644 --- a/docs/reference/plot.mkinfit.html +++ b/docs/reference/plot.mkinfit.html @@ -66,7 +66,7 @@ If the current plot device is a tikz device, mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/plot.mmkin.html b/docs/reference/plot.mmkin.html index 829105bd..0599907d 100644 --- a/docs/reference/plot.mmkin.html +++ b/docs/reference/plot.mmkin.html @@ -65,7 +65,7 @@ If the current plot device is a tikz device, mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/print.mkinds.html b/docs/reference/print.mkinds.html index 70c4f768..86bb58e5 100644 --- a/docs/reference/print.mkinds.html +++ b/docs/reference/print.mkinds.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/print.mkinmod.html b/docs/reference/print.mkinmod.html index 141dd1c9..bc4c644a 100644 --- a/docs/reference/print.mkinmod.html +++ b/docs/reference/print.mkinmod.html @@ -61,7 +61,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/schaefer07_complex_case.html b/docs/reference/schaefer07_complex_case.html index 18f3b78f..b212aa53 100644 --- a/docs/reference/schaefer07_complex_case.html +++ b/docs/reference/schaefer07_complex_case.html @@ -63,7 +63,7 @@ mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/sigma_twocomp.html b/docs/reference/sigma_twocomp.html index 8bf1d5f6..c8000ae5 100644 --- a/docs/reference/sigma_twocomp.html +++ b/docs/reference/sigma_twocomp.html @@ -66,7 +66,7 @@ This is the error model used for example by Werner et al. (1978). The model mkin - 0.9.47.2 + 0.9.47.3 diff --git a/docs/reference/summary.mkinfit.html b/docs/reference/summary.mkinfit.html index 7b7b0a31..28447e64 100644 --- a/docs/reference/summary.mkinfit.html +++ b/docs/reference/summary.mkinfit.html @@ -64,7 +64,7 @@ mkin - 0.9.47.2 + 0.9.47.3 @@ -204,17 +204,17 @@

Examples

-
summary(mkinfit(mkinmod(parent = mkinsub("SFO")), FOCUS_2006_A, quiet = TRUE))
#> mkin version used for fitting: 0.9.47.2 +
summary(mkinfit(mkinmod(parent = mkinsub("SFO")), FOCUS_2006_A, quiet = TRUE))
#> mkin version used for fitting: 0.9.47.3 #> R version used for fitting: 3.5.1 -#> Date of fit: Thu Sep 6 13:35:46 2018 -#> Date of summary: Thu Sep 6 13:35:46 2018 +#> Date of fit: Fri Sep 14 06:39:24 2018 +#> Date of summary: Fri Sep 14 06:39:24 2018 #> #> Equations: #> d_parent/dt = - k_parent_sink * parent #> #> Model predictions using solution type analytical #> -#> Fitted with method Port using 35 model solutions performed in 0.075 s +#> Fitted with method Port using 35 model solutions performed in 0.081 s #> #> Weighting: none #> diff --git a/docs/reference/synthetic_data_for_UBA.html b/docs/reference/synthetic_data_for_UBA.html index 9d9404e5..dd44a450 100644 --- a/docs/reference/synthetic_data_for_UBA.html +++ b/docs/reference/synthetic_data_for_UBA.html @@ -76,7 +76,7 @@ Compare also the code in the example section to see the degradation models." /> mkin - 0.9.47.2 + 0.9.47.3
diff --git a/docs/reference/test_data_from_UBA_2014.html b/docs/reference/test_data_from_UBA_2014.html index 5b683283..f9032c84 100644 --- a/docs/reference/test_data_from_UBA_2014.html +++ b/docs/reference/test_data_from_UBA_2014.html @@ -62,7 +62,7 @@ mkin - 0.9.47.2 + 0.9.47.3
diff --git a/docs/reference/transform_odeparms.html b/docs/reference/transform_odeparms.html index 1b94d319..a31b075e 100644 --- a/docs/reference/transform_odeparms.html +++ b/docs/reference/transform_odeparms.html @@ -69,7 +69,7 @@ The transformation of sets of formation fractions is fragile, as it supposes mkin - 0.9.47.2 + 0.9.47.3 @@ -198,10 +198,10 @@ The transformation of sets of formation fractions is fragile, as it supposes parent = list(type = "SFO", to = "m1", sink = TRUE), m1 = list(type = "SFO"))
#> Successfully compiled differential equation model from auto-generated C code.
# Fit the model to the FOCUS example dataset D using defaults fit <- mkinfit(SFO_SFO, FOCUS_2006_D, quiet = TRUE) -summary(fit, data=FALSE) # See transformed and backtransformed parameters
#> mkin version used for fitting: 0.9.47.2 +summary(fit, data=FALSE) # See transformed and backtransformed parameters
#> mkin version used for fitting: 0.9.47.3 #> R version used for fitting: 3.5.1 -#> Date of fit: Thu Sep 6 13:35:48 2018 -#> Date of summary: Thu Sep 6 13:35:48 2018 +#> Date of fit: Fri Sep 14 06:39:25 2018 +#> Date of summary: Fri Sep 14 06:39:25 2018 #> #> Equations: #> d_parent/dt = - k_parent_sink * parent - k_parent_m1 * parent @@ -209,7 +209,7 @@ The transformation of sets of formation fractions is fragile, as it supposes #> #> Model predictions using solution type deSolve #> -#> Fitted with method Port using 153 model solutions performed in 0.619 s +#> Fitted with method Port using 153 model solutions performed in 0.642 s #> #> Weighting: none #> -- cgit v1.2.1