/tools/bidd-molmap

bidd-molmap

shenwanxiang/bidd-molmap

145 stars34 forksJupyter NotebookWebsiteAdded February 4, 2026
summary

MolMapNet is a deep learning framework that utilizes knowledge-based molecular representations to predict molecular properties. It provides tools for feature extraction, distance calculation, and visualization, making it suitable for tasks in drug discovery and molecular property prediction.

description

MolMapNet: An Efficient ConvNet with Knowledge-based Molecular Represenations for Molecular Deep Learning

topics

deep-learningdrug-discoveryfingerprintdescriptorsmolmapnetpharmacophorefpmolecular-represenation

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