ProQSAR — automation utilities for QSAR workflows (standardization, featurization, model building & evaluation).

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  • License: MIT License (MIT)
  • Author: Tuyet Minh Phan
  • Requires: Python >=3.11
  • Provides-Extra: all , dev , docs , ml , viz
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Project description

ProQSAR

Automatic pipeline for QSAR modeling

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Toolkit for CADD ProQSAR For more details on each utility within the repository, please refer to the documentation provided in the respective folders.

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ProQSAR

License

This project is licensed under MIT License - see the License file for details.

Acknowledgments

This work has received support from the Korea International Cooperation Agency (KOICA) under the project entitled “Education and Research Capacity Building Project at University of Medicine and Pharmacy at Ho Chi Minh City”, conducted from 2024 to 2025 (Project No. 2021-00020-3).

Project details

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  • License: MIT License (MIT)
  • Author: Tuyet Minh Phan
  • Requires: Python >=3.11
  • Provides-Extra: all , dev , docs , ml , viz
Classifiers

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