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Case Western Reserve University, Aropha Inc.
- Cleveland, Ohio, USA
- https://www.aropha.com/
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predicting-heavy-metal-adsorption-in-soil
predicting-heavy-metal-adsorption-in-soil PublicA machine learning model based on gradient boosting decision tree for predicting heavy metal adsorption in soil.
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aerobic-biodeg-xgb-regressor
aerobic-biodeg-xgb-regressor PublicA machine learning model for the aerobic biodegradation prediction (regression) based on XGBoost as the major ML algorithm and MACCS fingerprint as the chemical representation.
Jupyter Notebook
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aerobic-biodeg-xgb-classifier
aerobic-biodeg-xgb-classifier PublicA machine learning model for the aerobic biodegradation prediction (classification) based on XGBoost as the major ML algorithm and MACCS fingerprint as the chemical representation.
Jupyter Notebook
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dreamhost-flask-project-setup
dreamhost-flask-project-setup PublicForked from Aropha/dreamhost-flask-project-setup
Step by step guidance for setting up Flask on DreamHost for web app deployment.
Python
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get-chemical-smiles-by-cas-or-name
get-chemical-smiles-by-cas-or-name PublicForked from Aropha/get-chemical-smiles-by-cas-or-name
Looking for chemical names, CAS numbers, and SMILES strings with python automation.
Jupyter Notebook
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