diff options
Diffstat (limited to 'docs/dev/reference')
| -rw-r--r-- | docs/dev/reference/Rplot001.png | bin | 19395 -> 1011 bytes | |||
| -rw-r--r-- | docs/dev/reference/mccall81_245T-1.png | bin | 0 -> 65341 bytes | |||
| -rw-r--r-- | docs/dev/reference/mccall81_245T.html | 77 | ||||
| -rw-r--r-- | docs/dev/reference/saem.html | 50 | ||||
| -rw-r--r-- | docs/dev/reference/summary.saem.mmkin.html | 432 | 
5 files changed, 296 insertions, 263 deletions
| diff --git a/docs/dev/reference/Rplot001.png b/docs/dev/reference/Rplot001.pngBinary files differ index bca41e2c..17a35806 100644 --- a/docs/dev/reference/Rplot001.png +++ b/docs/dev/reference/Rplot001.png diff --git a/docs/dev/reference/mccall81_245T-1.png b/docs/dev/reference/mccall81_245T-1.pngBinary files differ new file mode 100644 index 00000000..5daa5f18 --- /dev/null +++ b/docs/dev/reference/mccall81_245T-1.png diff --git a/docs/dev/reference/mccall81_245T.html b/docs/dev/reference/mccall81_245T.html index fa352d0a..255c3568 100644 --- a/docs/dev/reference/mccall81_245T.html +++ b/docs/dev/reference/mccall81_245T.html @@ -74,7 +74,7 @@        </button>        <span class="navbar-brand">          <a class="navbar-link" href="../index.html">mkin</a> -        <span class="version label label-info" data-toggle="tooltip" data-placement="bottom" title="In-development version">0.9.50.3</span> +        <span class="version label label-info" data-toggle="tooltip" data-placement="bottom" title="In-development version">0.9.50.4</span>        </span>      </div> @@ -122,7 +122,7 @@        </ul>        <ul class="nav navbar-nav navbar-right">          <li> -  <a href="http://github.com/jranke/mkin/"> +  <a href="https://github.com/jranke/mkin/">      <span class="fab fa fab fa-github fa-lg"></span>    </a> @@ -151,12 +151,12 @@   extracts.</p>      </div> -    <pre class="usage"><span class='no'>mccall81_245T</span></pre> +    <pre class="usage"><span class='va'>mccall81_245T</span></pre>      <h2 class="hasAnchor" id="format"><a class="anchor" href="#format"></a>Format</h2> -    <p>A dataframe containing the following variables.</p><dl'> +    <p>A dataframe containing the following variables.</p><dl>      <dt><code>name</code></dt><dd><p>the name of the compound observed. Note that T245 is used as                         an acronym for 2,4,5-T. T245 is a legitimate object name                         in R, which is necessary for specifying models using @@ -174,46 +174,71 @@    <a href='http://dx.doi.org/10.1021/jf00103a026'>http://dx.doi.org/10.1021/jf00103a026</a></p>      <h2 class="hasAnchor" id="examples"><a class="anchor" href="#examples"></a>Examples</h2> -    <pre class="examples"><div class='input'>  <span class='no'>SFO_SFO_SFO</span> <span class='kw'><-</span> <span class='fu'><a href='mkinmod.html'>mkinmod</a></span>(<span class='kw'>T245</span> <span class='kw'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span>(<span class='kw'>type</span> <span class='kw'>=</span> <span class='st'>"SFO"</span>, <span class='kw'>to</span> <span class='kw'>=</span> <span class='st'>"phenol"</span>), -                         <span class='kw'>phenol</span> <span class='kw'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span>(<span class='kw'>type</span> <span class='kw'>=</span> <span class='st'>"SFO"</span>, <span class='kw'>to</span> <span class='kw'>=</span> <span class='st'>"anisole"</span>), -                         <span class='kw'>anisole</span> <span class='kw'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span>(<span class='kw'>type</span> <span class='kw'>=</span> <span class='st'>"SFO"</span>))</div><div class='output co'>#> <span class='message'>Successfully compiled differential equation model from auto-generated C code.</span></div><div class='input'>  <span class='co'># \dontrun{</span> -    <span class='no'>fit.1</span> <span class='kw'><-</span> <span class='fu'><a href='mkinfit.html'>mkinfit</a></span>(<span class='no'>SFO_SFO_SFO</span>, <span class='fu'><a href='https://rdrr.io/r/base/subset.html'>subset</a></span>(<span class='no'>mccall81_245T</span>, <span class='no'>soil</span> <span class='kw'>==</span> <span class='st'>"Commerce"</span>), <span class='kw'>quiet</span> <span class='kw'>=</span> <span class='fl'>TRUE</span>)</div><div class='output co'>#> <span class='warning'>Warning: Observations with value of zero were removed from the data</span></div><div class='input'>    <span class='fu'><a href='https://rdrr.io/r/base/summary.html'>summary</a></span>(<span class='no'>fit.1</span>)$<span class='no'>bpar</span></div><div class='output co'>#>                         Estimate  se_notrans   t value       Pr(>t) -#> T245_0              1.038550e+02 2.184707514 47.537272 4.472189e-18 -#> k_T245              4.337042e-02 0.001898397 22.845818 2.276912e-13 -#> k_phenol            4.050581e-01 0.298699428  1.356073 9.756994e-02 -#> k_anisole           6.678742e-03 0.000802144  8.326114 2.623179e-07 -#> f_T245_to_phenol    6.227599e-01 0.398534167  1.562626 6.949418e-02 -#> f_phenol_to_anisole 1.000000e+00 0.671844168  1.488440 7.867794e-02 -#> sigma               2.514628e+00 0.490755943  5.123989 6.233164e-05 +    <pre class="examples"><div class='input'>  <span class='va'>SFO_SFO_SFO</span> <span class='op'><-</span> <span class='fu'><a href='mkinmod.html'>mkinmod</a></span><span class='op'>(</span>T245 <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span>type <span class='op'>=</span> <span class='st'>"SFO"</span>, to <span class='op'>=</span> <span class='st'>"phenol"</span><span class='op'>)</span>, +    phenol <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span>type <span class='op'>=</span> <span class='st'>"SFO"</span>, to <span class='op'>=</span> <span class='st'>"anisole"</span><span class='op'>)</span>, +    anisole <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span>type <span class='op'>=</span> <span class='st'>"SFO"</span><span class='op'>)</span><span class='op'>)</span> +</div><div class='output co'>#> <span class='message'>Successfully compiled differential equation model from auto-generated C code.</span></div><div class='input'>  <span class='co'># \dontrun{</span> +    <span class='va'>fit.1</span> <span class='op'><-</span> <span class='fu'><a href='mkinfit.html'>mkinfit</a></span><span class='op'>(</span><span class='va'>SFO_SFO_SFO</span>, <span class='fu'><a href='https://rdrr.io/r/base/subset.html'>subset</a></span><span class='op'>(</span><span class='va'>mccall81_245T</span>, <span class='va'>soil</span> <span class='op'>==</span> <span class='st'>"Commerce"</span><span class='op'>)</span>, quiet <span class='op'>=</span> <span class='cn'>TRUE</span><span class='op'>)</span> +</div><div class='output co'>#> <span class='warning'>Warning: Observations with value of zero were removed from the data</span></div><div class='input'>    <span class='fu'><a href='https://rdrr.io/r/base/summary.html'>summary</a></span><span class='op'>(</span><span class='va'>fit.1</span><span class='op'>)</span><span class='op'>$</span><span class='va'>bpar</span> +</div><div class='output co'>#>                         Estimate   se_notrans   t value       Pr(>t) +#> T245_0              1.038550e+02 2.1847074888 47.537272 4.472189e-18 +#> k_T245              4.337042e-02 0.0018983965 22.845818 2.276911e-13 +#> k_phenol            4.050581e-01 0.2986993400  1.356073 9.756988e-02 +#> k_anisole           6.678742e-03 0.0008021439  8.326114 2.623176e-07 +#> f_T245_to_phenol    6.227599e-01 0.3985340295  1.562627 6.949412e-02 +#> f_phenol_to_anisole 1.000000e+00 0.6718439378  1.488441 7.867787e-02 +#> sigma               2.514628e+00 0.4907558750  5.123989 6.233156e-05  #>                            Lower        Upper -#> T245_0              99.246061371 1.084640e+02 +#> T245_0              99.246061370 1.084640e+02  #> k_T245               0.039631621 4.746194e-02  #> k_phenol             0.218013878 7.525762e-01  #> k_anisole            0.005370739 8.305299e-03 -#> f_T245_to_phenol     0.547559082 6.924813e-01 +#> f_T245_to_phenol     0.547559083 6.924813e-01  #> f_phenol_to_anisole  0.000000000 1.000000e+00 -#> sigma                1.706607296 3.322649e+00</div><div class='input'>    <span class='fu'><a href='endpoints.html'>endpoints</a></span>(<span class='no'>fit.1</span>)</div><div class='output co'>#> $ff +#> sigma                1.706607296 3.322649e+00</div><div class='input'>    <span class='fu'><a href='endpoints.html'>endpoints</a></span><span class='op'>(</span><span class='va'>fit.1</span><span class='op'>)</span> +</div><div class='output co'>#> $ff  #>    T245_phenol      T245_sink phenol_anisole    phenol_sink  -#>   6.227599e-01   3.772401e-01   1.000000e+00   1.748047e-10  +#>   6.227599e-01   3.772401e-01   1.000000e+00   6.894640e-11   #>   #> $distimes  #>               DT50      DT90  #> T245     15.982025  53.09114  #> phenol    1.711229   5.68458  #> anisole 103.784092 344.76329 -#> </div><div class='input'>    <span class='co'># k_phenol_sink is really small, therefore fix it to zero</span> -    <span class='no'>fit.2</span> <span class='kw'><-</span> <span class='fu'><a href='mkinfit.html'>mkinfit</a></span>(<span class='no'>SFO_SFO_SFO</span>, <span class='fu'><a href='https://rdrr.io/r/base/subset.html'>subset</a></span>(<span class='no'>mccall81_245T</span>, <span class='no'>soil</span> <span class='kw'>==</span> <span class='st'>"Commerce"</span>), -                   <span class='kw'>parms.ini</span> <span class='kw'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/c.html'>c</a></span>(<span class='kw'>k_phenol_sink</span> <span class='kw'>=</span> <span class='fl'>0</span>), -                   <span class='kw'>fixed_parms</span> <span class='kw'>=</span> <span class='st'>"k_phenol_sink"</span>, <span class='kw'>quiet</span> <span class='kw'>=</span> <span class='fl'>TRUE</span>)</div><div class='output co'>#> <span class='warning'>Warning: Observations with value of zero were removed from the data</span></div><div class='output co'>#> <span class='warning'>Warning: Initial parameter(s) k_phenol_sink not used in the model</span></div><div class='output co'>#> <span class='error'>Error in data.frame(value = c(state.ini.fixed, parms.fixed)): row names contain missing values</span></div><div class='input'>    <span class='fu'><a href='https://rdrr.io/r/base/summary.html'>summary</a></span>(<span class='no'>fit.2</span>)$<span class='no'>bpar</span></div><div class='output co'>#> <span class='error'>Error in summary(fit.2): object 'fit.2' not found</span></div><div class='input'>    <span class='fu'><a href='endpoints.html'>endpoints</a></span>(<span class='no'>fit.1</span>)</div><div class='output co'>#> $ff +#> </div><div class='input'>    <span class='co'># formation fraction from phenol to anisol is practically 1. As we cannot</span> +    <span class='co'># fix formation fractions when using the ilr transformation, we can turn of</span> +    <span class='co'># the sink in the model generation</span> +    <span class='va'>SFO_SFO_SFO_2</span> <span class='op'><-</span> <span class='fu'><a href='mkinmod.html'>mkinmod</a></span><span class='op'>(</span>T245 <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span>type <span class='op'>=</span> <span class='st'>"SFO"</span>, to <span class='op'>=</span> <span class='st'>"phenol"</span><span class='op'>)</span>, +      phenol <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span>type <span class='op'>=</span> <span class='st'>"SFO"</span>, to <span class='op'>=</span> <span class='st'>"anisole"</span>, sink <span class='op'>=</span> <span class='cn'>FALSE</span><span class='op'>)</span>, +      anisole <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span>type <span class='op'>=</span> <span class='st'>"SFO"</span><span class='op'>)</span><span class='op'>)</span> +</div><div class='output co'>#> <span class='message'>Successfully compiled differential equation model from auto-generated C code.</span></div><div class='input'>    <span class='va'>fit.2</span> <span class='op'><-</span> <span class='fu'><a href='mkinfit.html'>mkinfit</a></span><span class='op'>(</span><span class='va'>SFO_SFO_SFO_2</span>, <span class='fu'><a href='https://rdrr.io/r/base/subset.html'>subset</a></span><span class='op'>(</span><span class='va'>mccall81_245T</span>, <span class='va'>soil</span> <span class='op'>==</span> <span class='st'>"Commerce"</span><span class='op'>)</span>, +      quiet <span class='op'>=</span> <span class='cn'>TRUE</span><span class='op'>)</span> +</div><div class='output co'>#> <span class='warning'>Warning: Observations with value of zero were removed from the data</span></div><div class='input'>    <span class='fu'><a href='https://rdrr.io/r/base/summary.html'>summary</a></span><span class='op'>(</span><span class='va'>fit.2</span><span class='op'>)</span><span class='op'>$</span><span class='va'>bpar</span> +</div><div class='output co'>#>                      Estimate   se_notrans   t value       Pr(>t)        Lower +#> T245_0           1.038550e+02 2.1623653027 48.028439 4.993108e-19 99.271020526 +#> k_T245           4.337042e-02 0.0018343666 23.643268 3.573555e-14  0.039650977 +#> k_phenol         4.050582e-01 0.1177237248  3.440752 1.679252e-03  0.218746585 +#> k_anisole        6.678741e-03 0.0006829745  9.778903 1.872894e-08  0.005377083 +#> f_T245_to_phenol 6.227599e-01 0.0342197865 18.198825 2.039410e-12  0.547975628 +#> sigma            2.514628e+00 0.3790944250  6.633250 2.875782e-06  1.710983655 +#>                         Upper +#> T245_0           108.43904097 +#> k_T245             0.04743877 +#> k_phenol           0.75005577 +#> k_anisole          0.00829550 +#> f_T245_to_phenol   0.69212306 +#> sigma              3.31827222</div><div class='input'>    <span class='fu'><a href='endpoints.html'>endpoints</a></span><span class='op'>(</span><span class='va'>fit.1</span><span class='op'>)</span> +</div><div class='output co'>#> $ff  #>    T245_phenol      T245_sink phenol_anisole    phenol_sink  -#>   6.227599e-01   3.772401e-01   1.000000e+00   1.748047e-10  +#>   6.227599e-01   3.772401e-01   1.000000e+00   6.894640e-11   #>   #> $distimes  #>               DT50      DT90  #> T245     15.982025  53.09114  #> phenol    1.711229   5.68458  #> anisole 103.784092 344.76329 -#> </div><div class='input'>    <span class='fu'><a href='plot.mkinfit.html'>plot_sep</a></span>(<span class='no'>fit.2</span>)</div><div class='output co'>#> <span class='error'>Error in identical(fit$err_mod, "const"): object 'fit.2' not found</span></div><div class='input'>  # } +#> </div><div class='input'>    <span class='fu'><a href='plot.mkinfit.html'>plot_sep</a></span><span class='op'>(</span><span class='va'>fit.2</span><span class='op'>)</span> +</div><div class='img'><img src='mccall81_245T-1.png' alt='' width='700' height='433' /></div><div class='input'>  <span class='co'># }</span>  </div></pre>    </div>    <div class="col-md-3 hidden-xs hidden-sm" id="pkgdown-sidebar"> @@ -230,7 +255,7 @@  </div>  <div class="pkgdown"> -  <p>Site built with <a href="https://pkgdown.r-lib.org/">pkgdown</a> 1.5.1.</p> +  <p>Site built with <a href="https://pkgdown.r-lib.org/">pkgdown</a> 1.6.1.</p>  </div>        </footer> diff --git a/docs/dev/reference/saem.html b/docs/dev/reference/saem.html index bc54e1e1..d0c3495a 100644 --- a/docs/dev/reference/saem.html +++ b/docs/dev/reference/saem.html @@ -141,7 +141,7 @@ Expectation Maximisation algorithm (SAEM)." />    <div class="col-md-9 contents">      <div class="page-header">      <h1>Fit nonlinear mixed models with SAEM</h1> -    <small class="dont-index">Source: <a href='https://github.com/jranke/mkin/blob/master/R/saemix.R'><code>R/saemix.R</code></a></small> +    <small class="dont-index">Source: <a href='https://github.com/jranke/mkin/blob/master/R/saem.R'><code>R/saem.R</code></a></small>      <div class="hidden name"><code>saem.Rd</code></div>      </div> @@ -161,6 +161,7 @@ Expectation Maximisation algorithm (SAEM).</p>    cores <span class='op'>=</span> <span class='fl'>1</span>,    verbose <span class='op'>=</span> <span class='cn'>FALSE</span>,    suppressPlot <span class='op'>=</span> <span class='cn'>TRUE</span>, +  quiet <span class='op'>=</span> <span class='cn'>FALSE</span>,    <span class='va'>...</span>  <span class='op'>)</span> @@ -185,19 +186,19 @@ Expectation Maximisation algorithm (SAEM).</p>      </tr>      <tr>        <th>...</th> -      <td><p>Further parameters passed to <a href='https://rdrr.io/pkg/saemix/man/saemixData.html'>saemix::saemixData</a> -and <a href='https://rdrr.io/pkg/saemix/man/saemixModel.html'>saemix::saemixModel</a>.</p></td> +      <td><p>Further parameters passed to <a href='https://rdrr.io/pkg/saemix/man/saemixModel.html'>saemix::saemixModel</a>.</p></td>      </tr>      <tr>        <th>cores</th>        <td><p>The number of cores to be used for multicore processing using  <code><a href='https://rdrr.io/r/parallel/mclapply.html'>parallel::mclapply()</a></code>. Using more than 1 core is experimental and may -lead to uncontrolled forking, apparently depending on the BLAS version +lead to excessive forking, apparently depending on the BLAS version  used.</p></td>      </tr>      <tr>        <th>verbose</th> -      <td><p>Should we print information about created objects?</p></td> +      <td><p>Should we print information about created objects of +type <a href='https://rdrr.io/pkg/saemix/man/SaemixModel-class.html'>saemix::SaemixModel</a> and <a href='https://rdrr.io/pkg/saemix/man/SaemixData-class.html'>saemix::SaemixData</a>?</p></td>      </tr>      <tr>        <th>suppressPlot</th> @@ -205,6 +206,11 @@ used.</p></td>  by the saemix function?</p></td>      </tr>      <tr> +      <th>quiet</th> +      <td><p>Should we suppress the messages saemix prints at the beginning +and the end of the optimisation process?</p></td> +    </tr> +    <tr>        <th>x</th>        <td><p>An saem.mmkin object to print</p></td>      </tr> @@ -241,27 +247,27 @@ using <a href='mmkin.html'>mmkin</a>.</p>    state.ini <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/c.html'>c</a></span><span class='op'>(</span>parent <span class='op'>=</span> <span class='fl'>100</span><span class='op'>)</span>, fixed_initials <span class='op'>=</span> <span class='st'>"parent"</span>, quiet <span class='op'>=</span> <span class='cn'>TRUE</span><span class='op'>)</span>  <span class='va'>f_saem_p0_fixed</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin_parent_p0_fixed</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Wed Nov 11 09:36:41 2020" +#> [1] "Wed Nov 11 19:47:58 2020"  #> ....  #>     Minimisation finished -#> [1] "Wed Nov 11 09:36:43 2020"</div><div class='input'> +#> [1] "Wed Nov 11 19:48:00 2020"</div><div class='input'>  <span class='va'>f_mmkin_parent</span> <span class='op'><-</span> <span class='fu'><a href='mmkin.html'>mmkin</a></span><span class='op'>(</span><span class='fu'><a href='https://rdrr.io/r/base/c.html'>c</a></span><span class='op'>(</span><span class='st'>"SFO"</span>, <span class='st'>"FOMC"</span>, <span class='st'>"DFOP"</span><span class='op'>)</span>, <span class='va'>ds</span>, quiet <span class='op'>=</span> <span class='cn'>TRUE</span><span class='op'>)</span>  <span class='va'>f_saem_sfo</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin_parent</span><span class='op'>[</span><span class='st'>"SFO"</span>, <span class='op'>]</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Wed Nov 11 09:36:44 2020" +#> [1] "Wed Nov 11 19:48:01 2020"  #> ....  #>     Minimisation finished -#> [1] "Wed Nov 11 09:36:45 2020"</div><div class='input'><span class='va'>f_saem_fomc</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin_parent</span><span class='op'>[</span><span class='st'>"FOMC"</span>, <span class='op'>]</span><span class='op'>)</span> +#> [1] "Wed Nov 11 19:48:03 2020"</div><div class='input'><span class='va'>f_saem_fomc</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin_parent</span><span class='op'>[</span><span class='st'>"FOMC"</span>, <span class='op'>]</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Wed Nov 11 09:36:46 2020" +#> [1] "Wed Nov 11 19:48:03 2020"  #> ....  #>     Minimisation finished -#> [1] "Wed Nov 11 09:36:48 2020"</div><div class='input'><span class='va'>f_saem_dfop</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin_parent</span><span class='op'>[</span><span class='st'>"DFOP"</span>, <span class='op'>]</span><span class='op'>)</span> +#> [1] "Wed Nov 11 19:48:05 2020"</div><div class='input'><span class='va'>f_saem_dfop</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin_parent</span><span class='op'>[</span><span class='st'>"DFOP"</span>, <span class='op'>]</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Wed Nov 11 09:36:48 2020" +#> [1] "Wed Nov 11 19:48:06 2020"  #> ....  #>     Minimisation finished -#> [1] "Wed Nov 11 09:36:51 2020"</div><div class='input'> +#> [1] "Wed Nov 11 19:48:08 2020"</div><div class='input'>  <span class='co'># The returned saem.mmkin object contains an SaemixObject, therefore we can use</span>  <span class='co'># functions from saemix</span>  <span class='kw'><a href='https://rdrr.io/r/base/library.html'>library</a></span><span class='op'>(</span><span class='va'>saemix</span><span class='op'>)</span> @@ -307,10 +313,10 @@ using <a href='mmkin.html'>mmkin</a>.</p>  <span class='va'>f_mmkin_parent_tc</span> <span class='op'><-</span> <span class='fu'><a href='https://rdrr.io/r/stats/update.html'>update</a></span><span class='op'>(</span><span class='va'>f_mmkin_parent</span>, error_model <span class='op'>=</span> <span class='st'>"tc"</span><span class='op'>)</span>  <span class='va'>f_saem_fomc_tc</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin_parent_tc</span><span class='op'>[</span><span class='st'>"FOMC"</span>, <span class='op'>]</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Wed Nov 11 09:36:54 2020" +#> [1] "Wed Nov 11 19:48:11 2020"  #> ....  #>     Minimisation finished -#> [1] "Wed Nov 11 09:36:59 2020"</div><div class='input'><span class='fu'><a href='https://rdrr.io/pkg/saemix/man/compare.saemix.html'>compare.saemix</a></span><span class='op'>(</span><span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span><span class='va'>f_saem_fomc</span><span class='op'>$</span><span class='va'>so</span>, <span class='va'>f_saem_fomc_tc</span><span class='op'>$</span><span class='va'>so</span><span class='op'>)</span><span class='op'>)</span> +#> [1] "Wed Nov 11 19:48:16 2020"</div><div class='input'><span class='fu'><a href='https://rdrr.io/pkg/saemix/man/compare.saemix.html'>compare.saemix</a></span><span class='op'>(</span><span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span><span class='va'>f_saem_fomc</span><span class='op'>$</span><span class='va'>so</span>, <span class='va'>f_saem_fomc_tc</span><span class='op'>$</span><span class='va'>so</span><span class='op'>)</span><span class='op'>)</span>  </div><div class='output co'>#> Likelihoods computed by importance sampling </div><div class='output co'>#>        AIC      BIC  #> 1 467.7096 464.9757  #> 2 469.5208 466.3963</div><div class='input'> @@ -330,15 +336,15 @@ using <a href='mmkin.html'>mmkin</a>.</p>  <span class='co'># solutions written for mkin this took around four minutes</span>  <span class='va'>f_saem_sfo_sfo</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin</span><span class='op'>[</span><span class='st'>"SFO-SFO"</span>, <span class='op'>]</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Wed Nov 11 09:37:01 2020" +#> [1] "Wed Nov 11 19:48:18 2020"  #> ....  #>     Minimisation finished -#> [1] "Wed Nov 11 09:37:06 2020"</div><div class='input'><span class='va'>f_saem_dfop_sfo</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin</span><span class='op'>[</span><span class='st'>"DFOP-SFO"</span>, <span class='op'>]</span><span class='op'>)</span> +#> [1] "Wed Nov 11 19:48:23 2020"</div><div class='input'><span class='va'>f_saem_dfop_sfo</span> <span class='op'><-</span> <span class='fu'>saem</span><span class='op'>(</span><span class='va'>f_mmkin</span><span class='op'>[</span><span class='st'>"DFOP-SFO"</span>, <span class='op'>]</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Wed Nov 11 09:37:06 2020" +#> [1] "Wed Nov 11 19:48:23 2020"  #> ....  #>     Minimisation finished -#> [1] "Wed Nov 11 09:37:15 2020"</div><div class='input'><span class='co'># We can use print, plot and summary methods to check the results</span> +#> [1] "Wed Nov 11 19:48:32 2020"</div><div class='input'><span class='co'># We can use print, plot and summary methods to check the results</span>  <span class='fu'><a href='https://rdrr.io/r/base/print.html'>print</a></span><span class='op'>(</span><span class='va'>f_saem_dfop_sfo</span><span class='op'>)</span>  </div><div class='output co'>#> Kinetic nonlinear mixed-effects model fit by SAEM  #> Structural model: @@ -384,8 +390,8 @@ using <a href='mmkin.html'>mmkin</a>.</p>  #> LL by is "-407.78 (df=13)"</div><div class='output co'>#> saemix version used for fitting:      3.1.9000   #> mkin version used for pre-fitting:  0.9.50.4   #> R version used for fitting:         4.0.3  -#> Date of fit:     Wed Nov 11 09:37:16 2020  -#> Date of summary: Wed Nov 11 09:37:16 2020  +#> Date of fit:     Wed Nov 11 19:48:33 2020  +#> Date of summary: Wed Nov 11 19:48:33 2020   #>   #> Equations:  #> d_parent/dt = - ((k1 * g * exp(-k1 * time) + k2 * (1 - g) * exp(-k2 * @@ -400,7 +406,7 @@ using <a href='mmkin.html'>mmkin</a>.</p>  #>   #> Model predictions using solution type analytical   #>  -#> Fitted in 9.691 s using 300, 100 iterations +#> Fitted in 9.564 s using 300, 100 iterations  #>   #> Variance model: Constant variance   #>  diff --git a/docs/dev/reference/summary.saem.mmkin.html b/docs/dev/reference/summary.saem.mmkin.html index e718806e..8a5d001a 100644 --- a/docs/dev/reference/summary.saem.mmkin.html +++ b/docs/dev/reference/summary.saem.mmkin.html @@ -156,7 +156,7 @@ endpoints such as formation fractions and DT50 values. Optionally      </div>      <pre class="usage"><span class='co'># S3 method for saem.mmkin</span> -<span class='fu'><a href='https://rdrr.io/r/base/summary.html'>summary</a></span><span class='op'>(</span><span class='va'>object</span>, data <span class='op'>=</span> <span class='cn'>FALSE</span>, verbose <span class='op'>=</span> <span class='cn'>FALSE</span>, distimes <span class='op'>=</span> <span class='cn'>TRUE</span>, <span class='va'>...</span><span class='op'>)</span> +<span class='fu'><a href='https://rdrr.io/pkg/saemix/man/summary-methods.html'>summary</a></span><span class='op'>(</span><span class='va'>object</span>, data <span class='op'>=</span> <span class='cn'>FALSE</span>, verbose <span class='op'>=</span> <span class='cn'>FALSE</span>, distimes <span class='op'>=</span> <span class='cn'>TRUE</span>, <span class='va'>...</span><span class='op'>)</span>  <span class='co'># S3 method for summary.saem.mmkin</span>  <span class='fu'><a href='https://rdrr.io/r/base/print.html'>print</a></span><span class='op'>(</span><span class='va'>x</span>, digits <span class='op'>=</span> <span class='fu'><a href='https://rdrr.io/r/base/Extremes.html'>max</a></span><span class='op'>(</span><span class='fl'>3</span>, <span class='fu'><a href='https://rdrr.io/r/base/options.html'>getOption</a></span><span class='op'>(</span><span class='st'>"digits"</span><span class='op'>)</span> <span class='op'>-</span> <span class='fl'>3</span><span class='op'>)</span>, verbose <span class='op'>=</span> <span class='va'>x</span><span class='op'>$</span><span class='va'>verbose</span>, <span class='va'>...</span><span class='op'>)</span></pre> @@ -256,18 +256,20 @@ saemix authors for the parts inherited from saemix.</p>  <span class='co'># \dontrun{</span>  <span class='co'># Evaluate using mmkin and saem</span> -<span class='va'>f_mmkin_dfop_sfo</span> <span class='op'><-</span> <span class='fu'><a href='mmkin.html'>mmkin</a></span><span class='op'>(</span><span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span><span class='va'>dfop_sfo</span><span class='op'>)</span>, <span class='va'>ds_syn_dfop_sfo</span>, quiet <span class='op'>=</span> <span class='cn'>TRUE</span>, error_model <span class='op'>=</span> <span class='st'>"tc"</span>, cores <span class='op'>=</span> <span class='fl'>5</span><span class='op'>)</span> +<span class='va'>f_mmkin_dfop_sfo</span> <span class='op'><-</span> <span class='fu'><a href='mmkin.html'>mmkin</a></span><span class='op'>(</span><span class='fu'><a href='https://rdrr.io/r/base/list.html'>list</a></span><span class='op'>(</span><span class='va'>dfop_sfo</span><span class='op'>)</span>, <span class='va'>ds_syn_dfop_sfo</span>, +  quiet <span class='op'>=</span> <span class='cn'>TRUE</span>, error_model <span class='op'>=</span> <span class='st'>"tc"</span>, cores <span class='op'>=</span> <span class='fl'>5</span><span class='op'>)</span>  <span class='va'>f_saem_dfop_sfo</span> <span class='op'><-</span> <span class='fu'><a href='saem.html'>saem</a></span><span class='op'>(</span><span class='va'>f_mmkin_dfop_sfo</span><span class='op'>)</span>  </div><div class='output co'>#> Running main SAEM algorithm -#> [1] "Mon Nov  9 09:24:08 2020" +#> [1] "Wed Nov 11 19:48:36 2020"  #> ....  #>     Minimisation finished -#> [1] "Mon Nov  9 09:24:21 2020"</div><div class='input'><span class='fu'><a href='https://rdrr.io/r/base/summary.html'>summary</a></span><span class='op'>(</span><span class='va'>f_saem_dfop_sfo</span>, data <span class='op'>=</span> <span class='cn'>TRUE</span><span class='op'>)</span> -</div><div class='output co'>#> saemix version used for fitting:      3.1.9000  +#> [1] "Wed Nov 11 19:48:48 2020"</div><div class='input'><span class='fu'><a href='https://rdrr.io/pkg/saemix/man/summary-methods.html'>summary</a></span><span class='op'>(</span><span class='va'>f_saem_dfop_sfo</span>, data <span class='op'>=</span> <span class='cn'>TRUE</span><span class='op'>)</span> +</div><div class='output co'>#>                            +#> LL by is "-401.01 (df=14)"</div><div class='output co'>#> saemix version used for fitting:      3.1.9000   #> mkin version used for pre-fitting:  0.9.50.4   #> R version used for fitting:         4.0.3  -#> Date of fit:     Mon Nov  9 09:24:22 2020  -#> Date of summary: Mon Nov  9 09:24:22 2020  +#> Date of fit:     Wed Nov 11 19:48:49 2020  +#> Date of summary: Wed Nov 11 19:48:49 2020   #>   #> Equations:  #> d_parent/dt = - ((k1 * g * exp(-k1 * time) + k2 * (1 - g) * exp(-k2 * @@ -282,7 +284,7 @@ saemix authors for the parts inherited from saemix.</p>  #>   #> Model predictions using solution type analytical   #>  -#> Fitted in 13.457 s using 300, 100 iterations +#> Fitted in 13.272 s using 300, 100 iterations  #>   #> Variance model: Two-component variance function   #>  @@ -298,232 +300,232 @@ saemix authors for the parts inherited from saemix.</p>  #> Results:  #>   #> Likelihood computed by importance sampling -#>        AIC     BIC   logLik -#>   828.8639 823.396 -400.432 +#>   AIC   BIC logLik +#>   830 824.5   -401  #>   #> Optimised, transformed parameters with symmetric confidence intervals: -#>                         est.      lower       upper -#> parent_0        101.35835807 97.8846505 104.8320657 -#> log_k_m1         -4.06644838 -4.1861445  -3.9467523 -#> f_parent_qlogis  -0.94818070 -1.3124706  -0.5838908 -#> log_k1           -2.92096208 -3.7684319  -2.0734922 -#> log_k2           -3.54529352 -4.2532018  -2.8373852 -#> g_qlogis         -0.09254475 -0.9675848   0.7824953 +#>                     est.  lower    upper +#> parent_0        101.4423 97.862 105.0224 +#> log_k_m1         -4.0703 -4.191  -3.9495 +#> f_parent_qlogis  -0.9539 -1.313  -0.5949 +#> log_k1           -2.9724 -3.811  -2.1342 +#> log_k2           -3.4977 -4.206  -2.7895 +#> g_qlogis         -0.0449 -1.116   1.0262  #>   #> Correlation:   #>                 prnt_0 lg_k_1 f_prn_ log_k1 log_k2 -#> log_k_m1        -0.217                             -#> f_parent_qlogis -0.153  0.203                      -#> log_k1           0.066 -0.067 -0.035               -#> log_k2           0.002  0.010  0.001 -0.041        -#> g_qlogis        -0.014  0.005  0.015 -0.163 -0.106 +#> log_k_m1        -0.207                             +#> f_parent_qlogis -0.148  0.202                      +#> log_k1           0.040 -0.038 -0.022               +#> log_k2           0.022 -0.015 -0.009  0.001        +#> g_qlogis        -0.012  0.005  0.011 -0.173 -0.130  #>   #> Random effects: -#>                          est.      lower     upper -#> SD.parent_0        2.70034095 -0.7003441 6.1010260 -#> SD.log_k_m1        0.08269959 -0.0456860 0.2110852 -#> SD.f_parent_qlogis 0.39452161  0.1376650 0.6513782 -#> SD.log_k1          0.90605744  0.2946394 1.5174755 -#> SD.log_k2          0.77604374  0.2646031 1.2874844 -#> SD.g_qlogis        0.37531563 -0.6836568 1.4342881 +#>                       est.   lower  upper +#> SD.parent_0        2.88564 -0.5163 6.2876 +#> SD.log_k_m1        0.08502 -0.0427 0.2127 +#> SD.f_parent_qlogis 0.38857  0.1350 0.6421 +#> SD.log_k1          0.92338  0.3296 1.5172 +#> SD.log_k2          0.78644  0.2817 1.2912 +#> SD.g_qlogis        0.34614 -0.8727 1.5650  #>   #> Variance model: -#>           est.      lower      upper -#> a.1 0.65736042 0.48750246 0.82721839 -#> b.1 0.06424086 0.05011127 0.07837046 +#>        est.   lower   upper +#> a.1 0.65859 0.49250 0.82469 +#> b.1 0.06411 0.05006 0.07817  #>   #> Backtransformed parameters with asymmetric confidence intervals: -#>                        est.       lower        upper -#> parent_0       101.35835807 97.88465048 104.83206565 -#> k_m1             0.01713815  0.01520479   0.01931734 -#> f_parent_to_m1   0.27925085  0.21207372   0.35803781 -#> k1               0.05388182  0.02308824   0.12574588 -#> k2               0.02886015  0.01421864   0.05857864 -#> g                0.47688031  0.27536216   0.68621766 +#>                     est.    lower     upper +#> parent_0       101.44231 97.86220 105.02241 +#> k_m1             0.01707  0.01513   0.01926 +#> f_parent_to_m1   0.27811  0.21201   0.35551 +#> k1               0.05118  0.02213   0.11834 +#> k2               0.03027  0.01491   0.06145 +#> g                0.48878  0.24675   0.73618  #>   #> Resulting formation fractions:  #>                 ff -#> parent_m1   0.2793 -#> parent_sink 0.7207 +#> parent_m1   0.2781 +#> parent_sink 0.7219  #>   #> Estimated disappearance times:  #>         DT50   DT90 DT50back DT50_k1 DT50_k2 -#> parent 17.57  63.28    19.05   12.86   24.02 -#> m1     40.44 134.35       NA      NA      NA +#> parent 17.53  61.64    18.55   13.54    22.9 +#> m1     40.60 134.88       NA      NA      NA  #>   #> Data: -#>    ds   name time observed  predicted  residual standardized -#>  ds 1 parent    0     89.8  9.848e+01  -8.68339     1.243323 -#>  ds 1 parent    0    104.1  9.848e+01   5.61661    -0.804209 -#>  ds 1 parent    1     88.7  9.403e+01  -5.32943     0.795687 -#>  ds 1 parent    1     95.5  9.403e+01   1.47057    -0.219557 -#>  ds 1 parent    3     81.8  8.584e+01  -4.04129     0.654791 -#>  ds 1 parent    3     94.5  8.584e+01   8.65871    -1.402929 -#>  ds 1 parent    7     71.5  7.196e+01  -0.46034     0.087182 -#>  ds 1 parent    7     70.3  7.196e+01  -1.66034     0.314448 -#>  ds 1 parent   14     54.2  5.384e+01   0.36125    -0.087766 -#>  ds 1 parent   14     49.6  5.384e+01  -4.23875     1.029821 -#>  ds 1 parent   28     31.5  3.220e+01  -0.69922     0.256514 -#>  ds 1 parent   28     28.8  3.220e+01  -3.39922     1.247025 -#>  ds 1 parent   60     12.1  1.264e+01  -0.53539     0.364441 -#>  ds 1 parent   60     13.6  1.264e+01   0.96461    -0.656614 -#>  ds 1 parent   90      6.2  6.081e+00   0.11929    -0.113824 -#>  ds 1 parent   90      8.3  6.081e+00   2.21929    -2.117659 -#>  ds 1 parent  120      2.2  3.055e+00  -0.85531     1.001955 -#>  ds 1 parent  120      2.4  3.055e+00  -0.65531     0.767664 -#>  ds 1     m1    1      0.3  1.115e+00  -0.81540     1.118502 -#>  ds 1     m1    1      0.2  1.115e+00  -0.91540     1.255673 -#>  ds 1     m1    3      2.2  3.111e+00  -0.91095     1.062691 -#>  ds 1     m1    3      3.0  3.111e+00  -0.11095     0.129432 -#>  ds 1     m1    7      6.5  6.292e+00   0.20799    -0.195930 -#>  ds 1     m1    7      5.0  6.292e+00  -1.29201     1.217079 -#>  ds 1     m1   14     10.2  9.886e+00   0.31362    -0.242650 -#>  ds 1     m1   14      9.5  9.886e+00  -0.38638     0.298948 -#>  ds 1     m1   28     12.2  1.259e+01  -0.39388     0.268603 -#>  ds 1     m1   28     13.4  1.259e+01   0.80612    -0.549726 -#>  ds 1     m1   60     11.8  1.092e+01   0.87659    -0.644982 -#>  ds 1     m1   60     13.2  1.092e+01   2.27659    -1.675083 -#>  ds 1     m1   90      6.6  7.814e+00  -1.21445     1.047509 -#>  ds 1     m1   90      9.3  7.814e+00   1.48555    -1.281347 -#>  ds 1     m1  120      3.5  5.275e+00  -1.77526     1.781944 -#>  ds 1     m1  120      5.4  5.275e+00   0.12474    -0.125213 -#>  ds 2 parent    0    118.0  1.045e+02  13.54366    -1.838241 -#>  ds 2 parent    0     99.8  1.045e+02  -4.65634     0.631992 -#>  ds 2 parent    1     90.2  9.872e+01  -8.51733     1.216927 -#>  ds 2 parent    1     94.6  9.872e+01  -4.11733     0.588270 -#>  ds 2 parent    3     96.1  8.872e+01   7.38009    -1.160975 -#>  ds 2 parent    3     78.4  8.872e+01 -10.31991     1.623443 -#>  ds 2 parent    7     77.9  7.337e+01   4.52584    -0.842647 -#>  ds 2 parent    7     77.7  7.337e+01   4.32584    -0.805409 -#>  ds 2 parent   14     56.0  5.616e+01  -0.15795     0.037034 -#>  ds 2 parent   14     54.7  5.616e+01  -1.45795     0.341841 -#>  ds 2 parent   28     36.6  3.859e+01  -1.99435     0.635813 -#>  ds 2 parent   28     36.8  3.859e+01  -1.79435     0.572052 -#>  ds 2 parent   60     22.1  2.113e+01   0.97273    -0.482843 -#>  ds 2 parent   60     24.7  2.113e+01   3.57273    -1.773425 -#>  ds 2 parent   90     12.4  1.258e+01  -0.17909     0.122205 -#>  ds 2 parent   90     10.8  1.258e+01  -1.77909     1.214019 -#>  ds 2 parent  120      6.8  7.509e+00  -0.70864     0.621767 -#>  ds 2 parent  120      7.9  7.509e+00   0.39136    -0.343380 -#>  ds 2     m1    1      1.3  1.466e+00  -0.16566     0.220431 -#>  ds 2     m1    3      3.7  3.947e+00  -0.24719     0.271357 -#>  ds 2     m1    3      4.7  3.947e+00   0.75281    -0.826421 -#>  ds 2     m1    7      8.1  7.501e+00   0.59910    -0.525881 -#>  ds 2     m1    7      7.9  7.501e+00   0.39910    -0.350323 -#>  ds 2     m1   14     10.1  1.082e+01  -0.71564     0.529253 -#>  ds 2     m1   14     10.3  1.082e+01  -0.51564     0.381342 -#>  ds 2     m1   28     10.7  1.248e+01  -1.78322     1.221977 -#>  ds 2     m1   28     12.2  1.248e+01  -0.28322     0.194082 -#>  ds 2     m1   60     10.7  1.058e+01   0.12295    -0.091967 -#>  ds 2     m1   60     12.5  1.058e+01   1.92295    -1.438427 -#>  ds 2     m1   90      9.1  8.029e+00   1.07074    -0.912688 -#>  ds 2     m1   90      7.4  8.029e+00  -0.62926     0.536381 -#>  ds 2     m1  120      6.1  5.816e+00   0.28391    -0.275375 -#>  ds 2     m1  120      4.5  5.816e+00  -1.31609     1.276529 -#>  ds 3 parent    0    106.2  1.048e+02   1.43237    -0.193885 -#>  ds 3 parent    0    106.9  1.048e+02   2.13237    -0.288636 -#>  ds 3 parent    1    107.4  9.616e+01  11.23530    -1.643774 -#>  ds 3 parent    1     96.1  9.616e+01  -0.06470     0.009466 -#>  ds 3 parent    3     79.4  8.238e+01  -2.97800     0.500554 -#>  ds 3 parent    3     82.6  8.238e+01   0.22200    -0.037315 -#>  ds 3 parent    7     63.9  6.427e+01  -0.36601     0.076477 -#>  ds 3 parent    7     62.4  6.427e+01  -1.86601     0.389900 -#>  ds 3 parent   14     51.0  4.825e+01   2.74941    -0.731807 -#>  ds 3 parent   14     47.1  4.825e+01  -1.15059     0.306250 -#>  ds 3 parent   28     36.1  3.501e+01   1.09474    -0.376700 -#>  ds 3 parent   28     36.6  3.501e+01   1.59474    -0.548750 -#>  ds 3 parent   60     20.1  2.050e+01  -0.40214     0.203675 -#>  ds 3 parent   60     19.8  2.050e+01  -0.70214     0.355617 -#>  ds 3 parent   90     11.3  1.257e+01  -1.27210     0.868328 -#>  ds 3 parent   90     10.7  1.257e+01  -1.87210     1.277883 -#>  ds 3 parent  120      8.2  7.710e+00   0.48984    -0.424960 -#>  ds 3 parent  120      7.3  7.710e+00  -0.41016     0.355837 -#>  ds 3     m1    0      0.8 -1.421e-13   0.80000    -1.216988 -#>  ds 3     m1    1      1.8  1.928e+00  -0.12842     0.164382 -#>  ds 3     m1    1      2.3  1.928e+00   0.37158    -0.475623 -#>  ds 3     m1    3      4.2  4.925e+00  -0.72511     0.744654 -#>  ds 3     m1    3      4.1  4.925e+00  -0.82511     0.847349 -#>  ds 3     m1    7      6.8  8.542e+00  -1.74215     1.444429 -#>  ds 3     m1    7     10.1  8.542e+00   1.55785    -1.291627 -#>  ds 3     m1   14     11.4  1.096e+01   0.44492    -0.326877 -#>  ds 3     m1   14     12.8  1.096e+01   1.84492    -1.355438 -#>  ds 3     m1   28     11.5  1.122e+01   0.27920    -0.202587 -#>  ds 3     m1   28     10.6  1.122e+01  -0.62080     0.450442 -#>  ds 3     m1   60      7.5  8.912e+00  -1.41171     1.147867 -#>  ds 3     m1   60      8.6  8.912e+00  -0.31171     0.253453 -#>  ds 3     m1   90      7.3  6.683e+00   0.61657    -0.567369 -#>  ds 3     m1   90      8.1  6.683e+00   1.41657    -1.303536 -#>  ds 3     m1  120      5.3  4.825e+00   0.47527    -0.491339 -#>  ds 3     m1  120      3.8  4.825e+00  -1.02473     1.059361 -#>  ds 4 parent    0    104.7  9.956e+01   5.14415    -0.729366 -#>  ds 4 parent    0     88.3  9.956e+01 -11.25585     1.595915 -#>  ds 4 parent    1     94.2  9.639e+01  -2.19462     0.320391 -#>  ds 4 parent    1     94.6  9.639e+01  -1.79462     0.261995 -#>  ds 4 parent    3     78.1  9.044e+01 -12.34368     1.908558 -#>  ds 4 parent    3     96.5  9.044e+01   6.05632    -0.936418 -#>  ds 4 parent    7     76.2  7.988e+01  -3.67799     0.635364 -#>  ds 4 parent    7     77.8  7.988e+01  -2.07799     0.358968 -#>  ds 4 parent   14     70.8  6.492e+01   5.88059    -1.218059 -#>  ds 4 parent   14     67.3  6.492e+01   2.38059    -0.493097 -#>  ds 4 parent   28     43.1  4.442e+01  -1.32411     0.377111 -#>  ds 4 parent   28     45.1  4.442e+01   0.67589    -0.192494 -#>  ds 4 parent   60     21.3  2.136e+01  -0.06143     0.030267 -#>  ds 4 parent   60     23.5  2.136e+01   2.13857    -1.053671 -#>  ds 4 parent   90     11.8  1.187e+01  -0.06548     0.046122 -#>  ds 4 parent   90     12.1  1.187e+01   0.23452    -0.165204 -#>  ds 4 parent  120      7.0  6.864e+00   0.13645    -0.124240 -#>  ds 4 parent  120      6.2  6.864e+00  -0.66355     0.604171 -#>  ds 4     m1    0      1.6  8.811e-13   1.60000    -2.433977 -#>  ds 4     m1    1      0.9  6.943e-01   0.20568    -0.293006 -#>  ds 4     m1    3      3.7  1.964e+00   1.73568    -2.215152 -#>  ds 4     m1    3      2.0  1.964e+00   0.03568    -0.045539 -#>  ds 4     m1    7      3.6  4.082e+00  -0.48184     0.523977 -#>  ds 4     m1    7      3.8  4.082e+00  -0.28184     0.306486 -#>  ds 4     m1   14      7.1  6.694e+00   0.40571    -0.373099 -#>  ds 4     m1   14      6.6  6.694e+00  -0.09429     0.086710 -#>  ds 4     m1   28      9.5  9.147e+00   0.35343    -0.283895 -#>  ds 4     m1   28      9.3  9.147e+00   0.15343    -0.123245 -#>  ds 4     m1   60      8.3  8.788e+00  -0.48803     0.399399 -#>  ds 4     m1   60      9.0  8.788e+00   0.21197    -0.173474 -#>  ds 4     m1   90      6.6  6.644e+00  -0.04431     0.040866 -#>  ds 4     m1   90      7.7  6.644e+00   1.05569    -0.973711 -#>  ds 4     m1  120      3.7  4.667e+00  -0.96735     1.010605 -#>  ds 4     m1  120      3.5  4.667e+00  -1.16735     1.219548 -#>  ds 5 parent    0    110.4  1.020e+02   8.37855    -1.161863 -#>  ds 5 parent    0    112.1  1.020e+02  10.07855    -1.397604 -#>  ds 5 parent    1     93.5  9.494e+01  -1.43722     0.212725 -#>  ds 5 parent    1     91.0  9.494e+01  -3.93722     0.582755 -#>  ds 5 parent    3     71.0  8.280e+01 -11.80256     1.974773 -#>  ds 5 parent    3     89.7  8.280e+01   6.89744    -1.154061 -#>  ds 5 parent    7     60.4  6.485e+01  -4.45291     0.923157 -#>  ds 5 parent    7     59.1  6.485e+01  -5.75291     1.192667 -#>  ds 5 parent   14     56.5  4.626e+01  10.24038    -2.821727 -#>  ds 5 parent   14     47.0  4.626e+01   0.74038    -0.204011 -#>  ds 5 parent   28     30.2  3.034e+01  -0.13506     0.051824 -#>  ds 5 parent   28     23.9  3.034e+01  -6.43506     2.469220 -#>  ds 5 parent   60     17.0  1.795e+01  -0.95206     0.525822 -#>  ds 5 parent   60     18.7  1.795e+01   0.74794    -0.413085 -#>  ds 5 parent   90     11.3  1.186e+01  -0.56163     0.395692 -#>  ds 5 parent   90     11.9  1.186e+01   0.03837    -0.027033 -#>  ds 5 parent  120      9.0  7.866e+00   1.13427    -0.975579 -#>  ds 5 parent  120      8.1  7.866e+00   0.23427    -0.201493 -#>  ds 5     m1    0      0.7 -4.263e-14   0.70000    -1.064865 -#>  ds 5     m1    1      3.0  3.169e+00  -0.16908     0.196384 -#>  ds 5     m1    1      2.6  3.169e+00  -0.56908     0.660990 -#>  ds 5     m1    3      5.1  8.455e+00  -3.35479     2.794486 -#>  ds 5     m1    3      7.5  8.455e+00  -0.95479     0.795325 -#>  ds 5     m1    7     16.5  1.577e+01   0.73235    -0.438460 -#>  ds 5     m1    7     19.0  1.577e+01   3.23235    -1.935208 -#>  ds 5     m1   14     22.9  2.202e+01   0.88393    -0.426673 -#>  ds 5     m1   14     23.2  2.202e+01   1.18393    -0.571482 -#>  ds 5     m1   28     22.2  2.399e+01  -1.79091     0.814583 -#>  ds 5     m1   28     24.4  2.399e+01   0.40909    -0.186073 -#>  ds 5     m1   60     15.5  1.872e+01  -3.21988     1.731175 -#>  ds 5     m1   60     19.8  1.872e+01   1.08012    -0.580725 -#>  ds 5     m1   90     14.9  1.383e+01   1.06749    -0.690500 -#>  ds 5     m1   90     14.2  1.383e+01   0.36749    -0.237710 -#>  ds 5     m1  120     10.9  1.004e+01   0.85568    -0.656897 -#>  ds 5     m1  120     10.4  1.004e+01   0.35568    -0.273054</div><div class='input'><span class='co'># }</span> +#>    ds   name time observed  predicted   residual standardized +#>  ds 1 parent    0     89.8  9.869e+01  -8.894553     1.273163 +#>  ds 1 parent    0    104.1  9.869e+01   5.405447    -0.773734 +#>  ds 1 parent    1     88.7  9.413e+01  -5.426448     0.810727 +#>  ds 1 parent    1     95.5  9.413e+01   1.373552    -0.205213 +#>  ds 1 parent    3     81.8  8.576e+01  -3.961821     0.643463 +#>  ds 1 parent    3     94.5  8.576e+01   8.738179    -1.419220 +#>  ds 1 parent    7     71.5  7.168e+01  -0.184828     0.035175 +#>  ds 1 parent    7     70.3  7.168e+01  -1.384828     0.263550 +#>  ds 1 parent   14     54.2  5.351e+01   0.688235    -0.168298 +#>  ds 1 parent   14     49.6  5.351e+01  -3.911765     0.956565 +#>  ds 1 parent   28     31.5  3.209e+01  -0.590445     0.217395 +#>  ds 1 parent   28     28.8  3.209e+01  -3.290445     1.211502 +#>  ds 1 parent   60     12.1  1.272e+01  -0.618158     0.419377 +#>  ds 1 parent   60     13.6  1.272e+01   0.881842    -0.598269 +#>  ds 1 parent   90      6.2  6.085e+00   0.115212    -0.109861 +#>  ds 1 parent   90      8.3  6.085e+00   2.215212    -2.112329 +#>  ds 1 parent  120      2.2  3.009e+00  -0.809439     0.950563 +#>  ds 1 parent  120      2.4  3.009e+00  -0.609439     0.715693 +#>  ds 1     m1    1      0.3  1.129e+00  -0.828817     1.133869 +#>  ds 1     m1    1      0.2  1.129e+00  -0.928817     1.270675 +#>  ds 1     m1    3      2.2  3.141e+00  -0.940880     1.094093 +#>  ds 1     m1    3      3.0  3.141e+00  -0.140880     0.163821 +#>  ds 1     m1    7      6.5  6.326e+00   0.174162    -0.163662 +#>  ds 1     m1    7      5.0  6.326e+00  -1.325838     1.245901 +#>  ds 1     m1   14     10.2  9.883e+00   0.317417    -0.245642 +#>  ds 1     m1   14      9.5  9.883e+00  -0.382583     0.296072 +#>  ds 1     m1   28     12.2  1.251e+01  -0.309856     0.212138 +#>  ds 1     m1   28     13.4  1.251e+01   0.890144    -0.609422 +#>  ds 1     m1   60     11.8  1.086e+01   0.940009    -0.693807 +#>  ds 1     m1   60     13.2  1.086e+01   2.340009    -1.727126 +#>  ds 1     m1   90      6.6  7.823e+00  -1.222977     1.054158 +#>  ds 1     m1   90      9.3  7.823e+00   1.477023    -1.273135 +#>  ds 1     m1  120      3.5  5.315e+00  -1.815201     1.816354 +#>  ds 1     m1  120      5.4  5.315e+00   0.084799    -0.084853 +#>  ds 2 parent    0    118.0  1.031e+02  14.876736    -2.046284 +#>  ds 2 parent    0     99.8  1.031e+02  -3.323264     0.457112 +#>  ds 2 parent    1     90.2  9.757e+01  -7.371379     1.066126 +#>  ds 2 parent    1     94.6  9.757e+01  -2.971379     0.429752 +#>  ds 2 parent    3     96.1  8.788e+01   8.222746    -1.306721 +#>  ds 2 parent    3     78.4  8.788e+01  -9.477254     1.506081 +#>  ds 2 parent    7     77.9  7.293e+01   4.972272    -0.932149 +#>  ds 2 parent    7     77.7  7.293e+01   4.772272    -0.894656 +#>  ds 2 parent   14     56.0  5.602e+01  -0.016773     0.003947 +#>  ds 2 parent   14     54.7  5.602e+01  -1.316773     0.309830 +#>  ds 2 parent   28     36.6  3.855e+01  -1.945779     0.621680 +#>  ds 2 parent   28     36.8  3.855e+01  -1.745779     0.557779 +#>  ds 2 parent   60     22.1  2.101e+01   1.086693    -0.541771 +#>  ds 2 parent   60     24.7  2.101e+01   3.686693    -1.838002 +#>  ds 2 parent   90     12.4  1.246e+01  -0.058759     0.040319 +#>  ds 2 parent   90     10.8  1.246e+01  -1.658759     1.138195 +#>  ds 2 parent  120      6.8  7.406e+00  -0.606226     0.534861 +#>  ds 2 parent  120      7.9  7.406e+00   0.493774    -0.435647 +#>  ds 2     m1    1      1.3  1.438e+00  -0.138236     0.184118 +#>  ds 2     m1    3      3.7  3.879e+00  -0.178617     0.196874 +#>  ds 2     m1    3      4.7  3.879e+00   0.821383    -0.905344 +#>  ds 2     m1    7      8.1  7.389e+00   0.710951    -0.627868 +#>  ds 2     m1    7      7.9  7.389e+00   0.510951    -0.451240 +#>  ds 2     m1   14     10.1  1.069e+01  -0.593533     0.441556 +#>  ds 2     m1   14     10.3  1.069e+01  -0.393533     0.292767 +#>  ds 2     m1   28     10.7  1.240e+01  -1.703647     1.171837 +#>  ds 2     m1   28     12.2  1.240e+01  -0.203647     0.140077 +#>  ds 2     m1   60     10.7  1.055e+01   0.147672    -0.110605 +#>  ds 2     m1   60     12.5  1.055e+01   1.947672    -1.458786 +#>  ds 2     m1   90      9.1  8.010e+00   1.090041    -0.929963 +#>  ds 2     m1   90      7.4  8.010e+00  -0.609959     0.520383 +#>  ds 2     m1  120      6.1  5.793e+00   0.306797    -0.297858 +#>  ds 2     m1  120      4.5  5.793e+00  -1.293203     1.255523 +#>  ds 3 parent    0    106.2  1.035e+02   2.712344    -0.371886 +#>  ds 3 parent    0    106.9  1.035e+02   3.412344    -0.467862 +#>  ds 3 parent    1    107.4  9.548e+01  11.924044    -1.758752 +#>  ds 3 parent    1     96.1  9.548e+01   0.624044    -0.092044 +#>  ds 3 parent    3     79.4  8.246e+01  -3.056105     0.514055 +#>  ds 3 parent    3     82.6  8.246e+01   0.143895    -0.024204 +#>  ds 3 parent    7     63.9  6.489e+01  -0.991141     0.205676 +#>  ds 3 parent    7     62.4  6.489e+01  -2.491141     0.516947 +#>  ds 3 parent   14     51.0  4.869e+01   2.306824    -0.610198 +#>  ds 3 parent   14     47.1  4.869e+01  -1.593176     0.421425 +#>  ds 3 parent   28     36.1  3.480e+01   1.304261    -0.451388 +#>  ds 3 parent   28     36.6  3.480e+01   1.804261    -0.624431 +#>  ds 3 parent   60     20.1  1.988e+01   0.221952    -0.114821 +#>  ds 3 parent   60     19.8  1.988e+01  -0.078048     0.040376 +#>  ds 3 parent   90     11.3  1.194e+01  -0.642458     0.451083 +#>  ds 3 parent   90     10.7  1.194e+01  -1.242458     0.872355 +#>  ds 3 parent  120      8.2  7.176e+00   1.023847    -0.915231 +#>  ds 3 parent  120      7.3  7.176e+00   0.123847    -0.110709 +#>  ds 3     m1    0      0.8  8.527e-13   0.800000    -1.214712 +#>  ds 3     m1    1      1.8  1.856e+00  -0.055925     0.071921 +#>  ds 3     m1    1      2.3  1.856e+00   0.444075    -0.571099 +#>  ds 3     m1    3      4.2  4.780e+00  -0.580164     0.601168 +#>  ds 3     m1    3      4.1  4.780e+00  -0.680164     0.704788 +#>  ds 3     m1    7      6.8  8.410e+00  -1.609920     1.344090 +#>  ds 3     m1    7     10.1  8.410e+00   1.690080    -1.411014 +#>  ds 3     m1   14     11.4  1.098e+01   0.424444    -0.311572 +#>  ds 3     m1   14     12.8  1.098e+01   1.824444    -1.339271 +#>  ds 3     m1   28     11.5  1.142e+01   0.079336    -0.057043 +#>  ds 3     m1   28     10.6  1.142e+01  -0.820664     0.590065 +#>  ds 3     m1   60      7.5  9.110e+00  -1.610231     1.295778 +#>  ds 3     m1   60      8.6  9.110e+00  -0.510231     0.410591 +#>  ds 3     m1   90      7.3  6.799e+00   0.501085    -0.457825 +#>  ds 3     m1   90      8.1  6.799e+00   1.301085    -1.188759 +#>  ds 3     m1  120      5.3  4.868e+00   0.431505    -0.444518 +#>  ds 3     m1  120      3.8  4.868e+00  -1.068495     1.100718 +#>  ds 4 parent    0    104.7  9.926e+01   5.444622    -0.775351 +#>  ds 4 parent    0     88.3  9.926e+01 -10.955378     1.560119 +#>  ds 4 parent    1     94.2  9.618e+01  -1.978413     0.289883 +#>  ds 4 parent    1     94.6  9.618e+01  -1.578413     0.231274 +#>  ds 4 parent    3     78.1  9.037e+01 -12.268550     1.901399 +#>  ds 4 parent    3     96.5  9.037e+01   6.131450    -0.950262 +#>  ds 4 parent    7     76.2  7.999e+01  -3.794958     0.655739 +#>  ds 4 parent    7     77.8  7.999e+01  -2.194958     0.379272 +#>  ds 4 parent   14     70.8  6.518e+01   5.624996    -1.162874 +#>  ds 4 parent   14     67.3  6.518e+01   2.124996    -0.439307 +#>  ds 4 parent   28     43.1  4.462e+01  -1.517860     0.431312 +#>  ds 4 parent   28     45.1  4.462e+01   0.482140    -0.137004 +#>  ds 4 parent   60     21.3  2.130e+01   0.003305    -0.001633 +#>  ds 4 parent   60     23.5  2.130e+01   2.203305    -1.088598 +#>  ds 4 parent   90     11.8  1.180e+01  -0.002834     0.002002 +#>  ds 4 parent   90     12.1  1.180e+01   0.297166    -0.209966 +#>  ds 4 parent  120      7.0  6.868e+00   0.132251    -0.120348 +#>  ds 4 parent  120      6.2  6.868e+00  -0.667749     0.607650 +#>  ds 4     m1    0      1.6  0.000e+00   1.600000    -2.429424 +#>  ds 4     m1    1      0.9  6.826e-01   0.217363    -0.309476 +#>  ds 4     m1    3      3.7  1.935e+00   1.765082    -2.255277 +#>  ds 4     m1    3      2.0  1.935e+00   0.065082    -0.083157 +#>  ds 4     m1    7      3.6  4.035e+00  -0.434805     0.474018 +#>  ds 4     m1    7      3.8  4.035e+00  -0.234805     0.255981 +#>  ds 4     m1   14      7.1  6.652e+00   0.448187    -0.413053 +#>  ds 4     m1   14      6.6  6.652e+00  -0.051813     0.047751 +#>  ds 4     m1   28      9.5  9.156e+00   0.343805    -0.276011 +#>  ds 4     m1   28      9.3  9.156e+00   0.143805    -0.115448 +#>  ds 4     m1   60      8.3  8.848e+00  -0.547762     0.446843 +#>  ds 4     m1   60      9.0  8.848e+00   0.152238    -0.124190 +#>  ds 4     m1   90      6.6  6.674e+00  -0.073979     0.068090 +#>  ds 4     m1   90      7.7  6.674e+00   1.026021    -0.944353 +#>  ds 4     m1  120      3.7  4.668e+00  -0.967537     1.010122 +#>  ds 4     m1  120      3.5  4.668e+00  -1.167537     1.218925 +#>  ds 5 parent    0    110.4  1.022e+02   8.170986    -1.132847 +#>  ds 5 parent    0    112.1  1.022e+02   9.870986    -1.368539 +#>  ds 5 parent    1     93.5  9.513e+01  -1.630764     0.241319 +#>  ds 5 parent    1     91.0  9.513e+01  -4.130764     0.611268 +#>  ds 5 parent    3     71.0  8.296e+01 -11.964279     2.001495 +#>  ds 5 parent    3     89.7  8.296e+01   6.735721    -1.126813 +#>  ds 5 parent    7     60.4  6.495e+01  -4.547441     0.942951 +#>  ds 5 parent    7     59.1  6.495e+01  -5.847441     1.212518 +#>  ds 5 parent   14     56.5  4.626e+01  10.241319    -2.825682 +#>  ds 5 parent   14     47.0  4.626e+01   0.741319    -0.204537 +#>  ds 5 parent   28     30.2  3.026e+01  -0.058478     0.022504 +#>  ds 5 parent   28     23.9  3.026e+01  -6.358478     2.446932 +#>  ds 5 parent   60     17.0  1.792e+01  -0.919046     0.508481 +#>  ds 5 parent   60     18.7  1.792e+01   0.780954    -0.432079 +#>  ds 5 parent   90     11.3  1.187e+01  -0.573917     0.404206 +#>  ds 5 parent   90     11.9  1.187e+01   0.026083    -0.018370 +#>  ds 5 parent  120      9.0  7.898e+00   1.102089    -0.946039 +#>  ds 5 parent  120      8.1  7.898e+00   0.202089    -0.173474 +#>  ds 5     m1    0      0.7 -1.421e-14   0.700000    -1.062873 +#>  ds 5     m1    1      3.0  3.144e+00  -0.143526     0.166865 +#>  ds 5     m1    1      2.6  3.144e+00  -0.543526     0.631910 +#>  ds 5     m1    3      5.1  8.390e+00  -3.290265     2.749870 +#>  ds 5     m1    3      7.5  8.390e+00  -0.890265     0.744048 +#>  ds 5     m1    7     16.5  1.566e+01   0.841368    -0.506082 +#>  ds 5     m1    7     19.0  1.566e+01   3.341368    -2.009830 +#>  ds 5     m1   14     22.9  2.188e+01   1.017753    -0.493689 +#>  ds 5     m1   14     23.2  2.188e+01   1.317753    -0.639212 +#>  ds 5     m1   28     22.2  2.386e+01  -1.655914     0.756794 +#>  ds 5     m1   28     24.4  2.386e+01   0.544086    -0.248661 +#>  ds 5     m1   60     15.5  1.859e+01  -3.091124     1.670405 +#>  ds 5     m1   60     19.8  1.859e+01   1.208876    -0.653262 +#>  ds 5     m1   90     14.9  1.372e+01   1.176815    -0.764948 +#>  ds 5     m1   90     14.2  1.372e+01   0.476815    -0.309937 +#>  ds 5     m1  120     10.9  9.961e+00   0.938796    -0.723690 +#>  ds 5     m1  120     10.4  9.961e+00   0.438796    -0.338255</div><div class='input'><span class='co'># }</span>  </div></pre>    </div> | 
