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Curie Web is a web interface for my private Python Library called "Curie", with some aditional superpowers.
This section deals with Molecular Docking and protein-ligand interactions. It uses AutoDock Vina[1] for docking, PyMOL[2] for visualisations, and PLIP[3] for interactions and binding site detection.
LSTM based on @topazape's LSTM_Chem[4], a Tensorflow implementation of the paper Generative Recurrent Networks for De Novo Drug Design[5]
Quick Searches for PubMed and PubChem are powered by their respective APIs. Qrious app is written in SwiftUI and uses the FigShare API along with a pre-trained BERT[6] model.