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last try to fix formulas for today...
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thomas-enzlein committed Aug 17, 2024
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22 changes: 7 additions & 15 deletions manual.Rmd
Original file line number Diff line number Diff line change
Expand Up @@ -197,39 +197,31 @@ In short: The *SSMD* gives the difference between the upper and lower part of th

##### Curve-repsonse-score (CRS)

$$
CRS=
$$CRS=
\begin{cases}
\frac{fcScore+vScore+zScore}{3}*100,\\
0 \quad for \quad Z'_{mod.}<-0.5 \quad or \quad V'_{mod.}<-0.5
\end{cases}
$$
\end{cases}$$

with

$$
fcScore=
$$fcScore=
\begin{cases}
1 \quad for \quad |log_2FC| > log_2FC_{max}\\
\frac{|log_2FC|}{log_2FC}
\end{cases}
$$
\end{cases}$$

and

$$
vScore=V'_{mod.}
$$
$$vScore=V'_{mod.}$$

and

$$
zScore=
$$zScore=
\begin{cases}
1 \quad for \quad Z'_{mod.}>0.5\\
\frac{Z'_{mod.}}{0.5} \quad for \quad 0.5 > Z'_{mod.}>-0.5
\end{cases}
$$
\end{cases}$$

The *CRS* combines three measures used to describe the quality of a response curve, the effect size defined as $Log_2FC$ and incorporated in the fcScore, the $V'_{mod.}$ factor being equal to the vScore and the $Z'_{mod.}$ factor used in the definition of the zScore. In the fcScore, the $Log_2FC$ is normalized by and thresholded at $Log_2FC_{max}=2.59$ . The factor is chosen to not overrate features that exhibit substantial changes. The restriction of the $Z'_{mod.}$ factor to the zScore is made due to the common interpretation of the *Z’* factor (Zhang, Chung and Oldenburg 1999). For $Z'_{mod.}>0.5$ a bioassay is said to be excellent, since for $\sigma_l=\sigma_u$ a value of 0.5 is equivalent to a separation of 12 standard deviations between $\mu_u$ and $\mu_l$ . Accordingly, a value of -0.5 is equivalent to a separation of 3 standard deviations between $\mu_u$ and $\mu_l$ for $\sigma_l=\sigma_u$ . The rather moderate lower threshold is in particular of importance for MALDI MS-based bioassay exhibiting a relatively high variance in the data.

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24 changes: 8 additions & 16 deletions manual.md
Original file line number Diff line number Diff line change
Expand Up @@ -37,7 +37,7 @@ The following features were already part of `MALDIcellassay`:

# General information

The blue question mark icons (<!--html_preserve--><i class="far fa-circle-question" role="presentation" aria-label="circle-question icon"></i><!--/html_preserve-->) throughout the application can be clicked and provide further information on the specific settings.
The blue question mark icons (preservef45ef1239f806958) throughout the application can be clicked and provide further information on the specific settings.

# Requirements to the raw data {#requirements-to-the-raw-data}

Expand Down Expand Up @@ -197,39 +197,31 @@ In short: The *SSMD* gives the difference between the upper and lower part of th

##### Curve-repsonse-score (CRS)

$$
CRS=
$$CRS=
\begin{cases}
\frac{fcScore+vScore+zScore}{3}*100,\\
0 \quad for \quad Z'_{mod.}<-0.5 \quad or \quad V'_{mod.}<-0.5
\end{cases}
$$
\end{cases}$$

with

$$
fcScore=
$$fcScore=
\begin{cases}
1 \quad for \quad |log_2FC| > log_2FC_{max}\\
\frac{|log_2FC|}{log_2FC}
\end{cases}
$$
\end{cases}$$

and

$$
vScore=V'_{mod.}
$$
$$vScore=V'_{mod.}$$

and

$$
zScore=
$$zScore=
\begin{cases}
1 \quad for \quad Z'_{mod.}>0.5\\
\frac{Z'_{mod.}}{0.5} \quad for \quad 0.5 > Z'_{mod.}>-0.5
\end{cases}
$$
\end{cases}$$

The *CRS* combines three measures used to describe the quality of a response curve, the effect size defined as $Log_2FC$ and incorporated in the fcScore, the $V'_{mod.}$ factor being equal to the vScore and the $Z'_{mod.}$ factor used in the definition of the zScore. In the fcScore, the $Log_2FC$ is normalized by and thresholded at $Log_2FC_{max}=2.59$ . The factor is chosen to not overrate features that exhibit substantial changes. The restriction of the $Z'_{mod.}$ factor to the zScore is made due to the common interpretation of the *Z’* factor (Zhang, Chung and Oldenburg 1999). For $Z'_{mod.}>0.5$ a bioassay is said to be excellent, since for $\sigma_l=\sigma_u$ a value of 0.5 is equivalent to a separation of 12 standard deviations between $\mu_u$ and $\mu_l$ . Accordingly, a value of -0.5 is equivalent to a separation of 3 standard deviations between $\mu_u$ and $\mu_l$ for $\sigma_l=\sigma_u$ . The rather moderate lower threshold is in particular of importance for MALDI MS-based bioassay exhibiting a relatively high variance in the data.

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