diff options
| author | Johannes Ranke <jranke@uni-bremen.de> | 2020-10-15 12:53:23 +0200 | 
|---|---|---|
| committer | Johannes Ranke <jranke@uni-bremen.de> | 2020-10-15 12:53:23 +0200 | 
| commit | 5b1179f0daff9077e1370065f9b9f03a2d0e0450 (patch) | |
| tree | 01f30f5763c279b942458843939d4f02be6ca455 /docs/articles/web_only/NAFTA_examples.html | |
| parent | 272aba066f0d7502e319b7e7f14009318cd44348 (diff) | |
Update online docs for release version
Diffstat (limited to 'docs/articles/web_only/NAFTA_examples.html')
| -rw-r--r-- | docs/articles/web_only/NAFTA_examples.html | 527 | 
1 files changed, 284 insertions, 243 deletions
| diff --git a/docs/articles/web_only/NAFTA_examples.html b/docs/articles/web_only/NAFTA_examples.html index b91e7ee7..411d4bb8 100644 --- a/docs/articles/web_only/NAFTA_examples.html +++ b/docs/articles/web_only/NAFTA_examples.html @@ -31,7 +31,7 @@        </button>        <span class="navbar-brand">          <a class="navbar-link" href="../../index.html">mkin</a> -        <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.9.50.2</span> +        <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.9.50.3</span>        </span>      </div> @@ -68,6 +68,9 @@      <li>        <a href="../../articles/web_only/NAFTA_examples.html">Example evaluation of NAFTA SOP Attachment examples</a>      </li> +    <li> +      <a href="../../articles/web_only/benchmarks.html">Some benchmark timings</a> +    </li>    </ul>  </li>  <li> @@ -76,7 +79,7 @@        </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> @@ -97,10 +100,10 @@        <h1 data-toc-skip>Evaluation of example datasets from Attachment 1 to the US EPA SOP for the NAFTA guidance</h1>                          <h4 class="author">Johannes Ranke</h4> -            <h4 class="date">2020-05-27</h4> +            <h4 class="date">2020-10-15</h4> -      <small class="dont-index">Source: <a href="http://github.com/jranke/mkin/blob/master/vignettes/web_only/NAFTA_examples.Rmd"><code>vignettes/web_only/NAFTA_examples.Rmd</code></a></small> -      <div class="hidden name"><code>NAFTA_examples.Rmd</code></div> +      <small class="dont-index">Source: <a href="https://github.com/jranke/mkin/blob/master/vignettes/web_only/NAFTA_examples.rmd"><code>vignettes/web_only/NAFTA_examples.rmd</code></a></small> +      <div class="hidden name"><code>NAFTA_examples.rmd</code></div>      </div> @@ -119,12 +122,15 @@  <div id="example-on-page-5-upper-panel" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-5-upper-panel" class="anchor"></a>Example on page 5, upper panel</h2> -<div class="sourceCode" id="cb1"><html><body><pre class="r"><span class="no">p5a</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p5a"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb1"><pre class="downlit"> +<span class="va">p5a</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p5a"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb4"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p5a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb4"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p5a</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p5a-1.png" width="700"></p> -<div class="sourceCode" id="cb5"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p5a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb5"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p5a</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##       SFO      IORE      DFOP   ## 465.21753  56.27506  32.06401  @@ -134,23 +140,23 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)  Lower   Upper -## parent_0       95.8401 4.67e-21 92.245 99.4357 -## k_parent_sink   0.0102 3.92e-12  0.009  0.0117 -## sigma           4.8230 3.81e-06  3.214  6.4318 +##          Estimate   Pr(>t)  Lower   Upper +## parent_0  95.8401 4.67e-21 92.245 99.4357 +## k_parent   0.0102 3.92e-12  0.009  0.0117 +## sigma      4.8230 3.81e-06  3.214  6.4318  ##   ## $IORE -##                     Estimate Pr(>t)    Lower    Upper -## parent_0            1.01e+02     NA 9.91e+01 1.02e+02 -## k__iore_parent_sink 1.54e-05     NA 4.08e-06 5.84e-05 -## N_parent            2.57e+00     NA 2.25e+00 2.89e+00 -## sigma               1.68e+00     NA 1.12e+00 2.24e+00 +##                Estimate Pr(>t)    Lower    Upper +## parent_0       1.01e+02     NA 9.91e+01 1.02e+02 +## k__iore_parent 1.54e-05     NA 4.08e-06 5.84e-05 +## N_parent       2.57e+00     NA 2.25e+00 2.89e+00 +## sigma          1.68e+00     NA 1.12e+00 2.24e+00  ##   ## $DFOP  ##          Estimate   Pr(>t)   Lower    Upper  ## parent_0 9.99e+01 1.41e-26 98.8116 101.0810  ## k1       2.67e-02 5.05e-06  0.0243   0.0295 -## k2       2.86e-12 5.00e-01  0.0000      Inf +## k2       2.17e-12 5.00e-01  0.0000      Inf  ## g        6.47e-01 3.67e-06  0.6248   0.6677  ## sigma    1.27e+00 8.91e-06  0.8395   1.6929  ##  @@ -159,7 +165,7 @@  ##      DT50     DT90 DT50_rep  ## SFO  67.7 2.25e+02 6.77e+01  ## IORE 58.2 1.07e+03 3.22e+02 -## DFOP 55.5 4.42e+11 2.42e+11 +## DFOP 55.5 5.83e+11 3.20e+11  ##   ## Representative half-life:  ## [1] 321.51</code></pre> @@ -167,12 +173,15 @@  <div id="example-on-page-5-lower-panel" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-5-lower-panel" class="anchor"></a>Example on page 5, lower panel</h2> -<div class="sourceCode" id="cb7"><html><body><pre class="r"><span class="no">p5b</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p5b"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb7"><pre class="downlit"> +<span class="va">p5b</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p5b"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb10"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p5b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb10"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p5b</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p5b-1.png" width="700"></p> -<div class="sourceCode" id="cb11"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p5b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb11"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p5b</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 94.81123 10.10936  7.55871  @@ -182,23 +191,23 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower    Upper -## parent_0        96.497 2.32e-24 94.85271 98.14155 -## k_parent_sink    0.008 3.42e-14  0.00737  0.00869 -## sigma            2.295 1.22e-05  1.47976  3.11036 +##          Estimate   Pr(>t)    Lower    Upper +## parent_0   96.497 2.32e-24 94.85271 98.14155 +## k_parent    0.008 3.42e-14  0.00737  0.00869 +## sigma       2.295 1.22e-05  1.47976  3.11036  ##   ## $IORE -##                     Estimate   Pr(>t)    Lower    Upper -## parent_0            9.85e+01 1.17e-28 9.79e+01 9.92e+01 -## k__iore_parent_sink 1.53e-04 6.50e-03 7.21e-05 3.26e-04 -## N_parent            1.94e+00 5.88e-13 1.76e+00 2.12e+00 -## sigma               7.49e-01 1.63e-05 4.82e-01 1.02e+00 +##                Estimate   Pr(>t)    Lower    Upper +## parent_0       9.85e+01 1.17e-28 9.79e+01 9.92e+01 +## k__iore_parent 1.53e-04 6.50e-03 7.21e-05 3.26e-04 +## N_parent       1.94e+00 5.88e-13 1.76e+00 2.12e+00 +## sigma          7.49e-01 1.63e-05 4.82e-01 1.02e+00  ##   ## $DFOP  ##          Estimate   Pr(>t)   Lower   Upper  ## parent_0 9.84e+01 1.24e-27 97.8078 98.9187  ## k1       1.55e-02 4.10e-04  0.0143  0.0167 -## k2       1.16e-11 5.00e-01  0.0000     Inf +## k2       1.04e-11 5.00e-01  0.0000     Inf  ## g        6.89e-01 2.92e-03  0.6626  0.7142  ## sigma    6.48e-01 2.38e-05  0.4147  0.8813  ##  @@ -207,7 +216,7 @@  ##      DT50     DT90 DT50_rep  ## SFO  86.6 2.88e+02 8.66e+01  ## IORE 85.5 7.17e+02 2.16e+02 -## DFOP 83.6 9.80e+10 5.98e+10 +## DFOP 83.6 1.09e+11 6.67e+10  ##   ## Representative half-life:  ## [1] 215.87</code></pre> @@ -215,12 +224,15 @@  <div id="example-on-page-6" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-6" class="anchor"></a>Example on page 6</h2> -<div class="sourceCode" id="cb13"><html><body><pre class="r"><span class="no">p6</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p6"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb13"><pre class="downlit"> +<span class="va">p6</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p6"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb16"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p6</span>)</pre></body></html></div> +<div class="sourceCode" id="cb16"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p6</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p6-1.png" width="700"></p> -<div class="sourceCode" id="cb17"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p6</span>)</pre></body></html></div> +<div class="sourceCode" id="cb17"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p6</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##       SFO      IORE      DFOP   ## 188.45361  51.00699  42.46931  @@ -230,23 +242,23 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)   Lower   Upper -## parent_0       94.7759 7.29e-24 92.3478 97.2039 -## k_parent_sink   0.0179 8.02e-16  0.0166  0.0194 -## sigma           3.0696 3.81e-06  2.0456  4.0936 +##          Estimate   Pr(>t)   Lower   Upper +## parent_0  94.7759 7.29e-24 92.3478 97.2039 +## k_parent   0.0179 8.02e-16  0.0166  0.0194 +## sigma      3.0696 3.81e-06  2.0456  4.0936  ##   ## $IORE -##                     Estimate   Pr(>t)    Lower    Upper -## parent_0            97.12446 2.63e-26 95.62461 98.62431 -## k__iore_parent_sink  0.00252 1.95e-03  0.00134  0.00472 -## N_parent             1.49587 4.07e-13  1.33896  1.65279 -## sigma                1.59698 5.05e-06  1.06169  2.13227 +##                Estimate   Pr(>t)    Lower    Upper +## parent_0       97.12446 2.63e-26 95.62461 98.62431 +## k__iore_parent  0.00252 1.95e-03  0.00134  0.00472 +## N_parent        1.49587 4.07e-13  1.33896  1.65279 +## sigma           1.59698 5.05e-06  1.06169  2.13227  ##   ## $DFOP  ##          Estimate   Pr(>t)   Lower   Upper  ## parent_0 9.66e+01 1.57e-25 95.3476 97.8979  ## k1       2.55e-02 7.33e-06  0.0233  0.0278 -## k2       4.90e-11 5.00e-01  0.0000     Inf +## k2       3.88e-11 5.00e-01  0.0000     Inf  ## g        8.61e-01 7.55e-06  0.8314  0.8867  ## sigma    1.46e+00 6.93e-06  0.9661  1.9483  ##  @@ -255,7 +267,7 @@  ##      DT50     DT90 DT50_rep  ## SFO  38.6 1.28e+02 3.86e+01  ## IORE 34.0 1.77e+02 5.32e+01 -## DFOP 34.1 6.66e+09 1.41e+10 +## DFOP 34.1 8.42e+09 1.79e+10  ##   ## Representative half-life:  ## [1] 53.17</code></pre> @@ -263,12 +275,15 @@  <div id="example-on-page-7" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-7" class="anchor"></a>Example on page 7</h2> -<div class="sourceCode" id="cb19"><html><body><pre class="r"><span class="no">p7</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p7"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb19"><pre class="downlit"> +<span class="va">p7</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p7"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb22"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p7</span>)</pre></body></html></div> +<div class="sourceCode" id="cb22"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p7</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p7-1.png" width="700"></p> -<div class="sourceCode" id="cb23"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p7</span>)</pre></body></html></div> +<div class="sourceCode" id="cb23"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p7</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 3661.661 3195.030 3174.145  @@ -278,23 +293,23 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower    Upper -## parent_0      96.41796 4.80e-53 93.32245 99.51347 -## k_parent_sink  0.00735 7.64e-21  0.00641  0.00843 -## sigma          7.94557 1.83e-15  6.46713  9.42401 +##          Estimate   Pr(>t)    Lower    Upper +## parent_0 96.41796 4.80e-53 93.32245 99.51347 +## k_parent  0.00735 7.64e-21  0.00641  0.00843 +## sigma     7.94557 1.83e-15  6.46713  9.42401  ##   ## $IORE -##                     Estimate Pr(>t)    Lower    Upper -## parent_0            9.92e+01     NA 9.55e+01 1.03e+02 -## k__iore_parent_sink 1.60e-05     NA 1.45e-07 1.77e-03 -## N_parent            2.45e+00     NA 1.35e+00 3.54e+00 -## sigma               7.42e+00     NA 6.04e+00 8.80e+00 +##                Estimate Pr(>t)    Lower    Upper +## parent_0       9.92e+01     NA 9.55e+01 1.03e+02 +## k__iore_parent 1.60e-05     NA 1.45e-07 1.77e-03 +## N_parent       2.45e+00     NA 1.35e+00 3.54e+00 +## sigma          7.42e+00     NA 6.04e+00 8.80e+00  ##   ## $DFOP  ##          Estimate   Pr(>t)   Lower    Upper  ## parent_0 9.89e+01 9.44e-49 95.4640 102.2573  ## k1       1.81e-02 1.75e-01  0.0116   0.0281 -## k2       1.97e-10 5.00e-01  0.0000      Inf +## k2       2.30e-10 5.00e-01  0.0000      Inf  ## g        6.06e-01 2.19e-01  0.4826   0.7178  ## sigma    7.40e+00 2.97e-15  6.0201   8.7754  ##  @@ -303,7 +318,7 @@  ##      DT50     DT90 DT50_rep  ## SFO  94.3 3.13e+02 9.43e+01  ## IORE 96.7 1.51e+03 4.55e+02 -## DFOP 96.4 6.97e+09 3.52e+09 +## DFOP 96.4 5.95e+09 3.01e+09  ##   ## Representative half-life:  ## [1] 454.55</code></pre> @@ -316,12 +331,15 @@  <h2 class="hasAnchor">  <a href="#example-on-page-8" class="anchor"></a>Example on page 8</h2>  <p>For this dataset, the IORE fit does not converge when the default starting values used by mkin for the IORE model are used. Therefore, a lower value for the rate constant is used here.</p> -<div class="sourceCode" id="cb25"><html><body><pre class="r"><span class="no">p8</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p8"</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__iore_parent_sink</span> <span class="kw">=</span> <span class="fl">1e-3</span>))</pre></body></html></div> +<div class="sourceCode" id="cb25"><pre class="downlit"> +<span class="va">p8</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p8"</span><span class="op">]</span><span class="op">]</span>, parms.ini <span class="op">=</span> <span class="fu"><a href="https://rdrr.io/r/base/c.html">c</a></span><span class="op">(</span>k__iore_parent <span class="op">=</span> <span class="fl">1e-3</span><span class="op">)</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb28"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p8</span>)</pre></body></html></div> +<div class="sourceCode" id="cb28"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p8</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p8-1.png" width="700"></p> -<div class="sourceCode" id="cb29"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p8</span>)</pre></body></html></div> +<div class="sourceCode" id="cb29"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p8</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##       SFO      IORE      DFOP   ## 1996.9408  444.9237  547.5616  @@ -331,17 +349,17 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower    Upper -## parent_0      88.16549 6.53e-29 83.37344 92.95754 -## k_parent_sink  0.00803 1.67e-13  0.00674  0.00957 -## sigma          7.44786 4.17e-10  5.66209  9.23363 +##          Estimate   Pr(>t)    Lower    Upper +## parent_0 88.16549 6.53e-29 83.37344 92.95754 +## k_parent  0.00803 1.67e-13  0.00674  0.00957 +## sigma     7.44786 4.17e-10  5.66209  9.23363  ##   ## $IORE -##                     Estimate   Pr(>t)    Lower    Upper -## parent_0            9.77e+01 7.03e-35 9.44e+01 1.01e+02 -## k__iore_parent_sink 6.14e-05 3.20e-02 2.12e-05 1.78e-04 -## N_parent            2.27e+00 4.23e-18 2.00e+00 2.54e+00 -## sigma               3.52e+00 5.36e-10 2.67e+00 4.36e+00 +##                Estimate   Pr(>t)    Lower    Upper +## parent_0       9.77e+01 7.03e-35 9.44e+01 1.01e+02 +## k__iore_parent 6.14e-05 3.20e-02 2.12e-05 1.78e-04 +## N_parent       2.27e+00 4.23e-18 2.00e+00 2.54e+00 +## sigma          3.52e+00 5.36e-10 2.67e+00 4.36e+00  ##   ## $DFOP  ##          Estimate   Pr(>t)    Lower    Upper @@ -368,12 +386,15 @@  <div id="example-on-page-9-upper-panel" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-9-upper-panel" class="anchor"></a>Example on page 9, upper panel</h2> -<div class="sourceCode" id="cb31"><html><body><pre class="r"><span class="no">p9a</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p9a"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb31"><pre class="downlit"> +<span class="va">p9a</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p9a"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb34"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p9a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb34"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p9a</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p9a-1.png" width="700"></p> -<div class="sourceCode" id="cb35"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p9a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb35"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p9a</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##       SFO      IORE      DFOP   ## 839.35238  88.57064   9.93363  @@ -383,23 +404,23 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)   Lower   Upper -## parent_0       88.1933 3.06e-12 79.9447 96.4419 -## k_parent_sink   0.0409 2.07e-07  0.0324  0.0516 -## sigma           7.2429 3.92e-05  4.4768 10.0090 +##          Estimate   Pr(>t)   Lower   Upper +## parent_0  88.1933 3.06e-12 79.9447 96.4419 +## k_parent   0.0409 2.07e-07  0.0324  0.0516 +## sigma      7.2429 3.92e-05  4.4768 10.0090  ##   ## $IORE -##                     Estimate   Pr(>t)    Lower    Upper -## parent_0            9.89e+01 1.12e-16 9.54e+01 1.02e+02 -## k__iore_parent_sink 1.93e-05 1.13e-01 3.49e-06 1.06e-04 -## N_parent            2.91e+00 1.45e-09 2.50e+00 3.32e+00 -## sigma               2.35e+00 5.31e-05 1.45e+00 3.26e+00 +##                Estimate   Pr(>t)    Lower    Upper +## parent_0       9.89e+01 1.12e-16 9.54e+01 1.02e+02 +## k__iore_parent 1.93e-05 1.13e-01 3.49e-06 1.06e-04 +## N_parent       2.91e+00 1.45e-09 2.50e+00 3.32e+00 +## sigma          2.35e+00 5.31e-05 1.45e+00 3.26e+00  ##   ## $DFOP  ##          Estimate   Pr(>t)  Lower  Upper  ## parent_0 9.85e+01 2.54e-20 97.390 99.672  ## k1       1.38e-01 3.52e-05  0.131  0.146 -## k2       6.02e-13 5.00e-01  0.000    Inf +## k2       6.69e-13 5.00e-01  0.000    Inf  ## g        6.52e-01 8.13e-06  0.642  0.661  ## sigma    7.88e-01 6.13e-02  0.481  1.095  ##  @@ -408,7 +429,7 @@  ##      DT50     DT90 DT50_rep  ## SFO  16.9 5.63e+01 1.69e+01  ## IORE 11.6 3.37e+02 1.01e+02 -## DFOP 10.5 2.07e+12 1.15e+12 +## DFOP 10.5 1.86e+12 1.04e+12  ##   ## Representative half-life:  ## [1] 101.43</code></pre> @@ -417,17 +438,15 @@  <div id="example-on-page-9-lower-panel" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-9-lower-panel" class="anchor"></a>Example on page 9, lower panel</h2> -<div class="sourceCode" id="cb37"><html><body><pre class="r"><span class="no">p9b</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p9b"</span>]])</pre></body></html></div> -<pre><code>## Warning in sqrt(diag(covar)): NaNs produced</code></pre> -<pre><code>## Warning in sqrt(diag(covar_notrans)): NaNs produced</code></pre> -<pre><code>## Warning in sqrt(1/diag(V)): NaNs produced</code></pre> -<pre><code>## Warning in cov2cor(ans$covar): diag(.) had 0 or NA entries; non-finite result is -## doubtful</code></pre> +<div class="sourceCode" id="cb37"><pre class="downlit"> +<span class="va">p9b</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p9b"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb44"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p9b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb40"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p9b</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p9b-1.png" width="700"></p> -<div class="sourceCode" id="cb45"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p9b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb41"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p9b</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 35.64867 23.22334 35.64867  @@ -437,24 +456,24 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)  Lower   Upper -## parent_0       94.7123 2.15e-19 93.178 96.2464 -## k_parent_sink   0.0389 4.47e-14  0.037  0.0408 -## sigma           1.5957 1.28e-04  0.932  2.2595 +##          Estimate   Pr(>t)  Lower   Upper +## parent_0  94.7123 2.15e-19 93.178 96.2464 +## k_parent   0.0389 4.47e-14  0.037  0.0408 +## sigma      1.5957 1.28e-04  0.932  2.2595  ##   ## $IORE -##                     Estimate   Pr(>t)   Lower  Upper -## parent_0              93.863 2.32e-18 92.4565 95.269 -## k__iore_parent_sink    0.127 1.85e-02  0.0504  0.321 -## N_parent               0.711 1.88e-05  0.4843  0.937 -## sigma                  1.288 1.76e-04  0.7456  1.830 +##                Estimate   Pr(>t)   Lower  Upper +## parent_0         93.863 2.32e-18 92.4565 95.269 +## k__iore_parent    0.127 1.85e-02  0.0504  0.321 +## N_parent          0.711 1.88e-05  0.4843  0.937 +## sigma             1.288 1.76e-04  0.7456  1.830  ##   ## $DFOP  ##          Estimate   Pr(>t)   Lower   Upper  ## parent_0  94.7123 1.61e-16 93.1355 96.2891  ## k1         0.0389 1.43e-06  0.0312  0.0485  ## k2         0.0389 6.67e-03  0.0186  0.0812 -## g          0.7742      NaN      NA      NA +## g          0.7742 5.00e-01  0.0000  1.0000  ## sigma      1.5957 2.50e-04  0.9135  2.2779  ##   ##  @@ -471,12 +490,15 @@  <div id="example-on-page-10" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-10" class="anchor"></a>Example on page 10</h2> -<div class="sourceCode" id="cb47"><html><body><pre class="r"><span class="no">p10</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p10"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb43"><pre class="downlit"> +<span class="va">p10</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p10"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb50"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p10</span>)</pre></body></html></div> +<div class="sourceCode" id="cb46"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p10</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p10-1.png" width="700"></p> -<div class="sourceCode" id="cb51"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p10</span>)</pre></body></html></div> +<div class="sourceCode" id="cb47"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p10</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 899.4089 336.4348 899.4089  @@ -486,25 +508,25 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)   Lower    Upper -## parent_0      101.7315 6.42e-11 91.9259 111.5371 -## k_parent_sink   0.0495 1.70e-07  0.0404   0.0607 -## sigma           8.0152 1.28e-04  4.6813  11.3491 +##          Estimate   Pr(>t)   Lower    Upper +## parent_0 101.7315 6.42e-11 91.9259 111.5371 +## k_parent   0.0495 1.70e-07  0.0404   0.0607 +## sigma      8.0152 1.28e-04  4.6813  11.3491  ##   ## $IORE -##                     Estimate   Pr(>t)  Lower   Upper -## parent_0               96.86 3.32e-12 90.848 102.863 -## k__iore_parent_sink     2.96 7.91e-02  0.687  12.761 -## N_parent                0.00 5.00e-01 -0.372   0.372 -## sigma                   4.90 1.77e-04  2.837   6.968 +##                Estimate   Pr(>t)  Lower   Upper +## parent_0          96.86 3.32e-12 90.848 102.863 +## k__iore_parent     2.96 7.91e-02  0.687  12.761 +## N_parent           0.00 5.00e-01 -0.372   0.372 +## sigma              4.90 1.77e-04  2.837   6.968  ##   ## $DFOP -##          Estimate   Pr(>t)   Lower    Upper -## parent_0 101.7315 1.41e-09 91.6534 111.8097 -## k1         0.0495 6.42e-04  0.0301   0.0814 -## k2         0.0495 1.66e-02  0.0200   0.1225 -## g          0.6634 5.00e-01  0.0000   1.0000 -## sigma      8.0152 2.50e-04  4.5886  11.4418 +##          Estimate   Pr(>t)   Lower   Upper +## parent_0 101.7315 1.41e-09 91.6534 111.810 +## k1         0.0495 6.48e-04  0.0303   0.081 +## k2         0.0495 1.67e-02  0.0201   0.122 +## g          0.6634 5.00e-01  0.0000   1.000 +## sigma      8.0152 2.50e-04  4.5886  11.442  ##   ##   ## DTx values: @@ -524,12 +546,15 @@  <div id="example-on-page-11" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-11" class="anchor"></a>Example on page 11</h2> -<div class="sourceCode" id="cb53"><html><body><pre class="r"><span class="no">p11</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p11"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb49"><pre class="downlit"> +<span class="va">p11</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p11"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb56"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p11</span>)</pre></body></html></div> +<div class="sourceCode" id="cb52"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p11</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p11-1.png" width="700"></p> -<div class="sourceCode" id="cb57"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p11</span>)</pre></body></html></div> +<div class="sourceCode" id="cb53"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p11</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 579.6805 204.7932 144.7783  @@ -539,17 +564,17 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower    Upper -## parent_0      96.15820 4.83e-13 90.24934 1.02e+02 -## k_parent_sink  0.00321 4.71e-05  0.00222 4.64e-03 -## sigma          6.43473 1.28e-04  3.75822 9.11e+00 +##          Estimate   Pr(>t)    Lower    Upper +## parent_0 96.15820 4.83e-13 90.24934 1.02e+02 +## k_parent  0.00321 4.71e-05  0.00222 4.64e-03 +## sigma     6.43473 1.28e-04  3.75822 9.11e+00  ##   ## $IORE -##                     Estimate Pr(>t)    Lower    Upper -## parent_0            1.05e+02     NA 9.90e+01 1.10e+02 -## k__iore_parent_sink 3.11e-17     NA 1.35e-20 7.18e-14 -## N_parent            8.36e+00     NA 6.62e+00 1.01e+01 -## sigma               3.82e+00     NA 2.21e+00 5.44e+00 +##                Estimate Pr(>t)    Lower    Upper +## parent_0       1.05e+02     NA 9.90e+01 1.10e+02 +## k__iore_parent 3.11e-17     NA 1.35e-20 7.18e-14 +## N_parent       8.36e+00     NA 6.62e+00 1.01e+01 +## sigma          3.82e+00     NA 2.21e+00 5.44e+00  ##   ## $DFOP  ##          Estimate   Pr(>t)    Lower    Upper @@ -567,7 +592,7 @@  ## DFOP 4.21e+11 2.64e+12 9.56e+11  ##   ## Representative half-life: -## [1] 41148169</code></pre> +## [1] 41148171</code></pre>  <p>In this case, the DFOP fit reported for PestDF resulted in a negative value for the slower rate constant, which is not possible in mkin. The other results are in agreement.</p>  </div>  </div> @@ -578,14 +603,17 @@  <div id="example-on-page-12-upper-panel" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-12-upper-panel" class="anchor"></a>Example on page 12, upper panel</h2> -<div class="sourceCode" id="cb59"><html><body><pre class="r"><span class="no">p12a</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p12a"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb55"><pre class="downlit"> +<span class="va">p12a</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p12a"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## Warning in summary.mkinfit(x): Could not calculate correlation; no covariance  ## matrix</code></pre>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb63"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p12a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb59"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p12a</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p12a-1.png" width="700"></p> -<div class="sourceCode" id="cb64"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p12a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb60"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p12a</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 695.4440 220.0685 695.4440  @@ -595,23 +623,23 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)  Lower   Upper -## parent_0       100.521 8.75e-12 92.461 108.581 -## k_parent_sink    0.124 3.61e-08  0.104   0.148 -## sigma            7.048 1.28e-04  4.116   9.980 +##          Estimate   Pr(>t)  Lower   Upper +## parent_0  100.521 8.75e-12 92.461 108.581 +## k_parent    0.124 3.61e-08  0.104   0.148 +## sigma       7.048 1.28e-04  4.116   9.980  ##   ## $IORE -##                     Estimate Pr(>t) Lower Upper -## parent_0              96.823     NA    NA    NA -## k__iore_parent_sink    2.436     NA    NA    NA -## N_parent               0.263     NA    NA    NA -## sigma                  3.965     NA    NA    NA +##                Estimate Pr(>t) Lower Upper +## parent_0         96.823     NA    NA    NA +## k__iore_parent    2.436     NA    NA    NA +## N_parent          0.263     NA    NA    NA +## sigma             3.965     NA    NA    NA  ##   ## $DFOP  ##          Estimate   Pr(>t)   Lower   Upper  ## parent_0  100.521 2.74e-10 92.2366 108.805 -## k1          0.124 5.74e-06  0.0958   0.161 -## k2          0.124 6.61e-02  0.0319   0.484 +## k1          0.124 5.75e-06  0.0958   0.161 +## k2          0.124 6.72e-02  0.0319   0.484  ## g           0.877 5.00e-01  0.0000   1.000  ## sigma       7.048 2.50e-04  4.0349  10.061  ##  @@ -628,7 +656,8 @@  <div id="example-on-page-12-lower-panel" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-12-lower-panel" class="anchor"></a>Example on page 12, lower panel</h2> -<div class="sourceCode" id="cb66"><html><body><pre class="r"><span class="no">p12b</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p12b"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb62"><pre class="downlit"> +<span class="va">p12b</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p12b"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## Warning in sqrt(diag(covar)): NaNs produced</code></pre>  <pre><code>## Warning in qt(alpha/2, rdf): NaNs produced</code></pre>  <pre><code>## Warning in qt(1 - alpha/2, rdf): NaNs produced</code></pre> @@ -639,9 +668,11 @@  ## doubtful</code></pre>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb76"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p12b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb72"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p12b</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p12b-1.png" width="700"></p> -<div class="sourceCode" id="cb77"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p12b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb73"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p12b</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 58.90242 19.06353 58.90242  @@ -651,17 +682,17 @@  ##   ## Parameters:  ## $SFO -##               Estimate  Pr(>t)   Lower    Upper -## parent_0       97.6840 0.00039 85.9388 109.4292 -## k_parent_sink   0.0589 0.00261  0.0431   0.0805 -## sigma           3.4323 0.04356 -1.2377   8.1023 +##          Estimate  Pr(>t)   Lower    Upper +## parent_0  97.6840 0.00039 85.9388 109.4292 +## k_parent   0.0589 0.00261  0.0431   0.0805 +## sigma      3.4323 0.04356 -1.2377   8.1023  ##   ## $IORE -##                     Estimate Pr(>t)     Lower  Upper -## parent_0              95.523 0.0055 74.539157 116.51 -## k__iore_parent_sink    0.333 0.1433  0.000717 154.57 -## N_parent               0.568 0.0677 -0.989464   2.13 -## sigma                  1.953 0.0975 -5.893100   9.80 +##                Estimate Pr(>t)     Lower  Upper +## parent_0         95.523 0.0055 74.539157 116.51 +## k__iore_parent    0.333 0.1433  0.000717 154.57 +## N_parent          0.568 0.0677 -0.989464   2.13 +## sigma             1.953 0.0975 -5.893100   9.80  ##   ## $DFOP  ##          Estimate Pr(>t) Lower Upper @@ -684,16 +715,15 @@  <div id="example-on-page-13" class="section level2">  <h2 class="hasAnchor">  <a href="#example-on-page-13" class="anchor"></a>Example on page 13</h2> -<div class="sourceCode" id="cb79"><html><body><pre class="r"><span class="no">p13</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p13"</span>]])</pre></body></html></div> -<pre><code>## Warning in sqrt(diag(covar)): NaNs produced</code></pre> -<pre><code>## Warning in sqrt(1/diag(V)): NaNs produced</code></pre> -<pre><code>## Warning in cov2cor(ans$covar): diag(.) had 0 or NA entries; non-finite result is -## doubtful</code></pre> +<div class="sourceCode" id="cb75"><pre class="downlit"> +<span class="va">p13</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p13"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb85"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p13</span>)</pre></body></html></div> +<div class="sourceCode" id="cb78"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p13</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p13-1.png" width="700"></p> -<div class="sourceCode" id="cb86"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p13</span>)</pre></body></html></div> +<div class="sourceCode" id="cb79"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p13</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 174.5971 142.3951 174.5971  @@ -703,24 +733,24 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower    Upper -## parent_0      92.73500 5.99e-17 89.61936 95.85065 -## k_parent_sink  0.00258 2.42e-09  0.00223  0.00299 -## sigma          3.41172 7.07e-05  2.05455  4.76888 +##          Estimate   Pr(>t)    Lower    Upper +## parent_0 92.73500 5.99e-17 89.61936 95.85065 +## k_parent  0.00258 2.42e-09  0.00223  0.00299 +## sigma     3.41172 7.07e-05  2.05455  4.76888  ##   ## $IORE -##                     Estimate   Pr(>t)    Lower  Upper -## parent_0             91.6016 6.34e-16 88.53086 94.672 -## k__iore_parent_sink   0.0396 2.36e-01  0.00207  0.759 -## N_parent              0.3541 1.46e-01 -0.35153  1.060 -## sigma                 3.0811 9.64e-05  1.84296  4.319 +##                Estimate   Pr(>t)    Lower  Upper +## parent_0        91.6016 6.34e-16 88.53086 94.672 +## k__iore_parent   0.0396 2.36e-01  0.00207  0.759 +## N_parent         0.3541 1.46e-01 -0.35153  1.060 +## sigma            3.0811 9.64e-05  1.84296  4.319  ##   ## $DFOP  ##          Estimate   Pr(>t)    Lower    Upper  ## parent_0 92.73500 9.25e-15 8.95e+01 9.59e+01 -## k1        0.00258 4.28e-01 1.70e-08 3.92e+02 +## k1        0.00258 4.28e-01 1.45e-08 4.61e+02  ## k2        0.00258 3.69e-08 2.20e-03 3.03e-03 -## g         0.00442 5.00e-01       NA       NA +## g         0.00442 5.00e-01 0.00e+00 1.00e+00  ## sigma     3.41172 1.35e-04 2.02e+00 4.80e+00  ##   ##  @@ -737,16 +767,19 @@  <div id="dt50-not-observed-in-the-study-and-dfop-problems-in-pestdf" class="section level1">  <h1 class="hasAnchor">  <a href="#dt50-not-observed-in-the-study-and-dfop-problems-in-pestdf" class="anchor"></a>DT50 not observed in the study and DFOP problems in PestDF</h1> -<div class="sourceCode" id="cb88"><html><body><pre class="r"><span class="no">p14</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p14"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb81"><pre class="downlit"> +<span class="va">p14</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p14"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## Warning in sqrt(diag(covar)): NaNs produced</code></pre>  <pre><code>## Warning in sqrt(1/diag(V)): NaNs produced</code></pre>  <pre><code>## Warning in cov2cor(ans$covar): diag(.) had 0 or NA entries; non-finite result is  ## doubtful</code></pre>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb94"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p14</span>)</pre></body></html></div> +<div class="sourceCode" id="cb87"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p14</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p14-1.png" width="700"></p> -<div class="sourceCode" id="cb95"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p14</span>)</pre></body></html></div> +<div class="sourceCode" id="cb88"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p14</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 48.43249 28.67746 27.26248  @@ -756,23 +789,23 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower    Upper -## parent_0      99.47124 2.06e-30 98.42254 1.01e+02 -## k_parent_sink  0.00279 3.75e-15  0.00256 3.04e-03 -## sigma          1.55616 3.81e-06  1.03704 2.08e+00 +##          Estimate   Pr(>t)    Lower    Upper +## parent_0 99.47124 2.06e-30 98.42254 1.01e+02 +## k_parent  0.00279 3.75e-15  0.00256 3.04e-03 +## sigma     1.55616 3.81e-06  1.03704 2.08e+00  ##   ## $IORE -##                     Estimate Pr(>t) Lower Upper -## parent_0            1.00e+02     NA   NaN   NaN -## k__iore_parent_sink 9.44e-08     NA   NaN   NaN -## N_parent            3.31e+00     NA   NaN   NaN -## sigma               1.20e+00     NA 0.796   1.6 +##                Estimate Pr(>t) Lower Upper +## parent_0       1.00e+02     NA   NaN   NaN +## k__iore_parent 9.44e-08     NA   NaN   NaN +## N_parent       3.31e+00     NA   NaN   NaN +## sigma          1.20e+00     NA 0.796   1.6  ##   ## $DFOP  ##          Estimate   Pr(>t)    Lower    Upper  ## parent_0 1.00e+02 2.96e-28 99.40280 101.2768  ## k1       9.53e-03 1.20e-01  0.00638   0.0143 -## k2       7.29e-12 5.00e-01  0.00000      Inf +## k2       7.70e-12 5.00e-01  0.00000      Inf  ## g        3.98e-01 2.19e-01  0.30481   0.4998  ## sigma    1.17e+00 7.68e-06  0.77406   1.5610  ##  @@ -781,7 +814,7 @@  ##          DT50     DT90 DT50_rep  ## SFO  2.48e+02 8.25e+02 2.48e+02  ## IORE 4.34e+02 2.22e+04 6.70e+03 -## DFOP 2.54e+10 2.46e+11 9.51e+10 +## DFOP 2.41e+10 2.33e+11 9.00e+10  ##   ## Representative half-life:  ## [1] 6697.44</code></pre> @@ -790,17 +823,19 @@  <div id="n-is-less-than-1-and-dfop-fraction-parameter-is-below-zero" class="section level1">  <h1 class="hasAnchor">  <a href="#n-is-less-than-1-and-dfop-fraction-parameter-is-below-zero" class="anchor"></a>N is less than 1 and DFOP fraction parameter is below zero</h1> -<div class="sourceCode" id="cb97"><html><body><pre class="r"><span class="no">p15a</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p15a"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb90"><pre class="downlit"> +<span class="va">p15a</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p15a"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## Warning in sqrt(diag(covar)): NaNs produced</code></pre> -<pre><code>## Warning in sqrt(diag(covar_notrans)): NaNs produced</code></pre>  <pre><code>## Warning in sqrt(1/diag(V)): NaNs produced</code></pre>  <pre><code>## Warning in cov2cor(ans$covar): diag(.) had 0 or NA entries; non-finite result is  ## doubtful</code></pre>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb104"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p15a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb96"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p15a</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p15a-1.png" width="700"></p> -<div class="sourceCode" id="cb105"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p15a</span>)</pre></body></html></div> +<div class="sourceCode" id="cb97"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p15a</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 245.5248 135.0132 245.5248  @@ -810,25 +845,25 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower   Upper -## parent_0      97.96751 2.00e-15 94.32049 101.615 -## k_parent_sink  0.00952 4.93e-09  0.00824   0.011 -## sigma          4.18778 1.28e-04  2.44588   5.930 +##          Estimate   Pr(>t)    Lower   Upper +## parent_0 97.96751 2.00e-15 94.32049 101.615 +## k_parent  0.00952 4.93e-09  0.00824   0.011 +## sigma     4.18778 1.28e-04  2.44588   5.930  ##   ## $IORE -##                     Estimate   Pr(>t)  Lower  Upper -## parent_0              95.874 2.94e-15 92.937 98.811 -## k__iore_parent_sink    0.629 2.11e-01  0.044  8.982 -## N_parent               0.000 5.00e-01 -0.642  0.642 -## sigma                  3.105 1.78e-04  1.795  4.416 +##                Estimate   Pr(>t)  Lower  Upper +## parent_0         95.874 2.94e-15 92.937 98.811 +## k__iore_parent    0.629 2.11e-01  0.044  8.982 +## N_parent          0.000 5.00e-01 -0.642  0.642 +## sigma             3.105 1.78e-04  1.795  4.416  ##   ## $DFOP -##          Estimate   Pr(>t)    Lower    Upper -## parent_0 97.96752 2.85e-13 94.21914 101.7159 -## k1        0.00952 6.80e-02  0.00277   0.0327 -## k2        0.00952 3.82e-06  0.00902   0.0100 -## g         0.17247      NaN       NA       NA -## sigma     4.18778 2.50e-04  2.39747   5.9781 +##          Estimate Pr(>t)    Lower    Upper +## parent_0 97.96752     NA 94.21914 101.7159 +## k1        0.00952     NA  0.00241   0.0377 +## k2        0.00952     NA  0.00747   0.0121 +## g         0.17247     NA       NA       NA +## sigma     4.18778     NA  2.39747   5.9781  ##   ##   ## DTx values: @@ -839,16 +874,19 @@  ##   ## Representative half-life:  ## [1] 41.33</code></pre> -<div class="sourceCode" id="cb107"><html><body><pre class="r"><span class="no">p15b</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p15b"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb99"><pre class="downlit"> +<span class="va">p15b</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p15b"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## Warning in sqrt(diag(covar)): NaNs produced</code></pre>  <pre><code>## Warning in sqrt(1/diag(V)): NaNs produced</code></pre>  <pre><code>## Warning in cov2cor(ans$covar): diag(.) had 0 or NA entries; non-finite result is  ## doubtful</code></pre>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The half-life obtained from the IORE model may be used</code></pre> -<div class="sourceCode" id="cb113"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p15b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb105"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p15b</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p15b-1.png" width="700"></p> -<div class="sourceCode" id="cb114"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p15b</span>)</pre></body></html></div> +<div class="sourceCode" id="cb106"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p15b</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##       SFO      IORE      DFOP   ## 106.91629  68.55574 106.91629  @@ -858,25 +896,25 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)    Lower    Upper -## parent_0      1.01e+02 3.06e-17 98.31594 1.03e+02 -## k_parent_sink 4.86e-03 2.48e-10  0.00435 5.42e-03 -## sigma         2.76e+00 1.28e-04  1.61402 3.91e+00 +##          Estimate   Pr(>t)    Lower    Upper +## parent_0 1.01e+02 3.06e-17 98.31594 1.03e+02 +## k_parent 4.86e-03 2.48e-10  0.00435 5.42e-03 +## sigma    2.76e+00 1.28e-04  1.61402 3.91e+00  ##   ## $IORE -##                     Estimate   Pr(>t)    Lower  Upper -## parent_0               99.83 1.81e-16 97.51349 102.14 -## k__iore_parent_sink     0.38 3.22e-01  0.00352  41.05 -## N_parent                0.00 5.00e-01 -1.07695   1.08 -## sigma                   2.21 2.57e-04  1.23245   3.19 +##                Estimate   Pr(>t)    Lower  Upper +## parent_0          99.83 1.81e-16 97.51348 102.14 +## k__iore_parent     0.38 3.22e-01  0.00352  41.05 +## N_parent           0.00 5.00e-01 -1.07696   1.08 +## sigma              2.21 2.57e-04  1.23245   3.19  ##   ## $DFOP  ##          Estimate Pr(>t)    Lower    Upper -## parent_0 1.01e+02     NA 9.82e+01 1.04e+02 -## k1       4.86e-03     NA 6.75e-04 3.49e-02 -## k2       4.86e-03     NA 3.37e-03 6.99e-03 +## parent_0 1.01e+02     NA 98.24464 1.04e+02 +## k1       4.86e-03     NA  0.00068 3.47e-02 +## k2       4.86e-03     NA  0.00338 6.99e-03  ## g        1.50e-01     NA       NA       NA -## sigma    2.76e+00     NA 1.58e+00 3.94e+00 +## sigma    2.76e+00     NA  1.58208 3.94e+00  ##   ##   ## DTx values: @@ -892,14 +930,17 @@  <div id="the-dfop-fraction-parameter-is-greater-than-1" class="section level1">  <h1 class="hasAnchor">  <a href="#the-dfop-fraction-parameter-is-greater-than-1" class="anchor"></a>The DFOP fraction parameter is greater than 1</h1> -<div class="sourceCode" id="cb116"><html><body><pre class="r"><span class="no">p16</span> <span class="kw"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span>(<span class="no">NAFTA_SOP_Attachment</span><span class="kw">[[</span><span class="st">"p16"</span>]])</pre></body></html></div> +<div class="sourceCode" id="cb108"><pre class="downlit"> +<span class="va">p16</span> <span class="op"><-</span> <span class="fu"><a href="../../reference/nafta.html">nafta</a></span><span class="op">(</span><span class="va">NAFTA_SOP_Attachment</span><span class="op">[[</span><span class="st">"p16"</span><span class="op">]</span><span class="op">]</span><span class="op">)</span></pre></div>  <pre><code>## The SFO model is rejected as S_SFO is equal or higher than the critical value S_c</code></pre>  <pre><code>## The representative half-life of the IORE model is longer than the one corresponding</code></pre>  <pre><code>## to the terminal degradation rate found with the DFOP model.</code></pre>  <pre><code>## The representative half-life obtained from the DFOP model may be used</code></pre> -<div class="sourceCode" id="cb121"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/plot.html">plot</a></span>(<span class="no">p16</span>)</pre></body></html></div> +<div class="sourceCode" id="cb113"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/graphics/plot.default.html">plot</a></span><span class="op">(</span><span class="va">p16</span><span class="op">)</span></pre></div>  <p><img src="NAFTA_examples_files/figure-html/p16-1.png" width="700"></p> -<div class="sourceCode" id="cb122"><html><body><pre class="r"><span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span>(<span class="no">p16</span>)</pre></body></html></div> +<div class="sourceCode" id="cb114"><pre class="downlit"> +<span class="fu"><a href="https://rdrr.io/r/base/print.html">print</a></span><span class="op">(</span><span class="va">p16</span><span class="op">)</span></pre></div>  <pre><code>## Sums of squares:  ##      SFO     IORE     DFOP   ## 3831.804 2062.008 1550.980  @@ -909,22 +950,22 @@  ##   ## Parameters:  ## $SFO -##               Estimate   Pr(>t)  Lower Upper -## parent_0        71.953 2.33e-13 60.509 83.40 -## k_parent_sink    0.159 4.86e-05  0.102  0.25 -## sigma           11.302 1.25e-08  8.308 14.30 +##          Estimate   Pr(>t)  Lower Upper +## parent_0   71.953 2.33e-13 60.509 83.40 +## k_parent    0.159 4.86e-05  0.102  0.25 +## sigma      11.302 1.25e-08  8.308 14.30  ##   ## $IORE -##                     Estimate   Pr(>t)    Lower    Upper -## parent_0            8.74e+01 2.48e-16 7.72e+01 97.52972 -## k__iore_parent_sink 4.55e-04 2.16e-01 3.48e-05  0.00595 -## N_parent            2.70e+00 1.21e-08 1.99e+00  3.40046 -## sigma               8.29e+00 1.61e-08 6.09e+00 10.49062 +##                Estimate   Pr(>t)    Lower    Upper +## parent_0       8.74e+01 2.48e-16 7.72e+01 97.52972 +## k__iore_parent 4.55e-04 2.16e-01 3.48e-05  0.00595 +## N_parent       2.70e+00 1.21e-08 1.99e+00  3.40046 +## sigma          8.29e+00 1.61e-08 6.09e+00 10.49062  ##   ## $DFOP  ##          Estimate   Pr(>t)   Lower  Upper  ## parent_0  88.5333 7.40e-18 79.9836 97.083 -## k1        18.5561 5.00e-01  0.0000    Inf +## k1        18.5560 5.00e-01  0.0000    Inf  ## k2         0.0776 1.41e-05  0.0518  0.116  ## g          0.4733 1.41e-09  0.3674  0.582  ## sigma      7.1902 2.11e-08  5.2785  9.102 @@ -972,7 +1013,7 @@  </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> | 
