For ADMET analysis, the library of 5784 compounds was manually curated by removing large structures such as peptides, macrocycles, larger molecular weight compounds and salts.
As such, pathways routing through currency metabolites tend to not be biologically meaningful, and for many algorithms, these currency compounds are manually removed [13, 14, 24, 31, 32].
Progressively larger and more diverse sets of manually classified chemicals (from 100+ compounds to more than 6000 compounds) were manually compared and evaluated against the computed ClassyFire classifications to ensure that the program properly classified new compounds or compounds not previously seen in its training cycles.
The top scoring 15,000 compounds were manually filtered to select compounds with chemically diverse scaffolds interacting with the greatest variety of discrete elements within the docking boxes.
After the battery is crushed into small pieces and washed, Pb compounds are manually or mechanically detached from the plastic and sulfuric acid solution.
Thus, in these pathway diagrams, biological entities, such as enzymes or compounds, are manually laid-out and the diagrams are easy to understand for biologists.
Compound information was manually retrieved from the literature, including journal articles and patents, which were selected using major databases like Pubmed [37], SciFinder [38], and Google.
The amplitude of this compound EPSC was manually increased up to the minimal value where spikes were elicited with a firing probability of 1 in at least 100 successive trials.
If found, the relevant compound name was assigned; otherwise, the compound was annotated manually or given a standard IUPAC name (ChemAxon, 2009).
Perinuclear localization was manually judged.
