Description Usage Arguments Details Value Examples
Takes structure data file (SDF) of candidate drug to predict its resistome using stochastic model.
1 | drug.resistome.stochastic("sdf", "NearestNeighbor", "Threshold", "Organism")
|
sdf |
input sdf file |
NearestNeighbor |
Nearest Neighbor = 1, 3 |
Threshold |
Threshold = 0.25, 0.3, 0.35, 0.4 |
Organism |
Escherichia coli = 1, Pseudomonas aeruginosa = 2 |
uCAREChemSuiteCLI
Predicted resistome of the candidate drug using Nearest Neighbor algorithm
1 2 3 4 | {
example.resistome.stochastic<- system.file('extdata/example.sdf', package="uCAREChemSuiteCLI")
drug.resistome.stochastic(example.resistome.stochastic, "3", "0.25", "1")
}
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