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The extra descriptor solved this problem in the test data set (Figure 1).
We used libPaDEL-Descriptor, which is included in the source code of PaDEL-Descriptor, to evaluate the performance of the PaDEL-Descriptor because it excludes the extra descriptor calculation time, such as the file IO and molecular preprocessing.
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These symbols are similar to the basic mission symbols, but contain a few extra descriptors.
Crowdsourcing has been gaining points as a method to collect metadata descriptors, adding extra alternative textual information to the one that already exists.
In some cases, information embedded within the SDFile can be used to complement the computed molecular descriptors, thus adding extra flexibility to the methods.
When using the original predicted adipose tissue's log Kt:p descriptor values (without any extra artificial noise), that descriptor occurs as the root node in all the 10 model trees built by Bagging.
Moreover, HTD profiles are available from national databases and do not require extra recording, in contrast to many herd management descriptors.
The B-descriptor (hydrogen bond basicity) of cinnamic acid is a little more than that of benzoic acid due to the extra C = C group, and this also slightly increases the S-descriptor and the L-descriptor.
An extra feature associated with the graphs consists on showing the distribution of descriptor values with respect to the target property using additional visualizations (Fig. 1c).
The USR and UF4 shape descriptors were then each separately combined with MACCS to form Hybrid descriptors and thus to see if the addition of extra three dimensional information would improve the virtual screening performance.
That's particularly bad news for women, the researchers say, because their comparative inactivity puts them at greater risk for metabolic syndrome, a descriptor for a cluster of related conditions such as high cholesterol, extra abdominal fat and high blood pressure that often lead to heart disease, stroke and Type 2 diabetes.
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Since I tried Ludwig back in 2017, I have been constantly using it in both editing and translation. Ever since, I suggest it to my translators at ProSciEditing.

Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com