yuxuanliao's repositories

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airPLS

baseline correction using adaptive iteratively reweighted Penalized Least Squares

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DeepPurpose

A Deep Learning Toolkit for DTI, Drug Property, PPI, DDI, Protein Function Prediction (Bioinformatics)

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dffROI

Fusion of Quality Evaluation Metrics and Convolutional Neural Network Representations for Accurate Peak Detection in LC-MS

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networkx

Network Analysis in Python

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pybaselines

A Python library of algorithms for the baseline correction of experimental data.

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pytorch_geometric

Graph Neural Network Library for PyTorch

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SigmaCCS

Highly accurate and large-scale collision cross section prediction with graph neural network for compound identification

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