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APDB: a database on air pollutants characterization and similarity prediction

APDB is a publicly available online database which improves our knowledge of the existing pollutant molecules, providing an in-depth insight into their physicochemical, structural and quantum properties. The collection of pollutant molecular structures together with all the chemical characteristics and descriptors provided in APDB, offers scientists a unique resource for a wide view of the biochemical aspects of pollutant toxicity mechanisms.

APDB is available at: http://apdb.di.univr.it

Local Setup

The APDB web application is currently available locally due to server maintenance and related services. Follow the steps below to run the app and access all its functionalities:

1. Clone the repository

git clone https://github.com/InfOmics/APDB
cd APDB/Flask

2. Start the app with Docker Compose

docker-compose up --build -d

3. Access the app

Open your browser at: http://localhost:5000

Note: You will be automatically redirected to /apdb/home.

4. Stopping the app

docker-compose down

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