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Table 4 An overall comparison between the three machine learning tools used in the predictions

From: Off-targetP ML: an open source machine learning framework for off-target panel safety assessment of small molecules

 

Neural Networks (via Tensorflow)

Random Forest

H2O driverless AI

AutoGluon

Auto-Sklearn

Availability

Open source

Open source

License required

Open source

Open source

Time consumption

(Subjective to model setting)

High

Low

High

Low

Low

Required skills

- High data science skills required in R or Python

- Basic data science skills required in R or Python

- No data science skills required for the user- interface

- Minimum Python or R experience required to use the backend framework. (R/Python API client)

- Basic experience required in python

- Basic experience required in python

Supported language

R or Python

R or Python

R or Python

Python only

Python only