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Update README.md
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jeffrichardchemistry authored Mar 10, 2021
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Expand Up @@ -9,6 +9,8 @@ A notebook file with an example of using this package is present in the director
<li><b>numpy</b></li>
<li><b>pandas</b></li>
<li><b>tqdm</b></li>
<li><b>scikit-learn</b></li>
<li><b>Tested in python3.6 and python3.8</b></li>
</ul>

## Install
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```

## How to use
This package has three classes: Smetrics (perform some statistical parameters like Q2ext R2ext etc), Similarity (realize similarity calculations based in differents metrics ) and ApplicabilityDomain (run a scan of AD with differents thresholds). The line code bellow import all classes
This package has three classes: Smetrics (perform some statistical parameters like Q2ext R2ext etc), Similarity (realize similarity calculations based in differents metrics ) and ApplicabilityDomain (run a scan of AD with differents thresholds). The line code bellow import all classes.
```
from pyADA import Smetrics, Similarity, ApplicabilityDomain
```
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