Hunter College, The City University of New York (XieResearchGroup)

Hunter College, The City University of New York

XieResearchGroup

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Home Page:http://compsci.hunter.cuny.edu/~leixie/index.html

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Hunter College, The City University of New York's repositories

Physics-aware-Multiplex-GNN

Code for our Nature Scientific Reports paper "A universal framework for accurate and efficient geometric deep learning of molecular systems"

CODE-AE

Coherent Deconfounding Autoencoder (CODE-AE) can extract both common biological signals shared by incoherent samples and private representations unique to each data set, transfer knowledge learned from cell line data to tissue data, and separate confounding factors from them

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DISAE

MSA-Regularized Protein Sequence Transformer toward Predicting Genome-Wide Chemical-Protein Interactions: Application to GPCRome Deorphanization

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DeepREAL

DeepREAL: A Deep Learning Powered Multi-scale Modeling Framework Towards Predicting Out-of-distribution Receptor Activity of Ligand Binding

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CLEIT

Cross-LEvel Information Transmission network (CLEIT) aims to represent the asymmetrical multi-level organization of the biological system by integrating multiple incoherent omics data. It first learns the latent representation of the high-level domain then uses it as ground-truth embedding to improve the representation learning of the low-level domain in the form of contrastive loss.

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PrePROTAC

PrePROTAC project

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JDINAC

Joint density-based Differential Interaction Network Analysis and Classification

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PLANS

Self Training Drug Side Effects Detector

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WINTF

weighted, imputed, neighbor-regularized matrix tri-factorization algorithm

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CPA

Source code for our paper "Improving Attention Mechanism in Graph Neural Networks via Cardinality Preservation" (IJCAI 2020)

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Interesting-DL-Materials

List of Interesting Deep Learning Materials

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L1000-bayesian

L1000 peak deconvolution based on Bayesian analysis

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L1000-repurposing

Drug repurposing with L1000 data

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Lab-wiki

Wiki of Xie's Lab

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MXMNet

Source code for our paper "Molecular Mechanics-Driven Graph Neural Network with Multiplex Graph for Molecular Structures"

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