activity
20192024
most citedMolTrans: Molecular Interaction Transformer for Drug Target Interaction Prediction

678 citations · 1.6k across the 35 of their papers we have counts for

collaborators
Showing 2020Show all

14 papers · 1 filter

cs.LG2020★ 3 cited

STELAR: Spatio-temporal Tensor Factorization with Latent Epidemiological Regularization

Nikos Kargas, Cheng Qian, Nicholas D. Sidiropoulos +3

Accurate prediction of the transmission of epidemic diseases such as COVID-19 is crucial for implementing effective mitigation measures. In this work, we develop a tensor method to…

eess.IV2020★ 5 cited

FLANNEL: Focal Loss Based Neural Network Ensemble for COVID-19 Detection

Zhi Qiao, Austin Bae, Lucas M. Glass +2

To test the possibility of differentiating chest x-ray images of COVID-19 against other pneumonia and healthy patients using deep neural networks. We construct the X-ray imaging da…

q-bio.QM2020★ 7 cited

MolDesigner: Interactive Design of Efficacious Drugs with Deep Learning

Kexin Huang, Tianfan Fu, Dawood Khan +7

The efficacy of a drug depends on its binding affinity to the therapeutic target and pharmacokinetics. Deep learning (DL) has demonstrated remarkable progress in predicting drug ef…

cs.LG2020★ 1 cited

UNITE: Uncertainty-based Health Risk Prediction Leveraging Multi-sourced Data

Chacha Chen, Junjie Liang, Fenglong Ma +3

Successful health risk prediction demands accuracy and reliability of the model. Existing predictive models mainly depend on mining electronic health records (EHR) with advanced de…

cs.LG2020★ 11 cited

MIMOSA: Multi-constraint Molecule Sampling for Molecule Optimization

Tianfan Fu, Cao Xiao, Xinhao Li +2

Molecule optimization is a fundamental task for accelerating drug discovery, with the goal of generating new valid molecules that maximize multiple drug properties while maintainin…

cs.LG2020★ 193 cited

SumGNN: Multi-typed Drug Interaction Prediction via Efficient Knowledge Graph Summarization

Yue Yu, Kexin Huang, Chao Zhang +3

Thanks to the increasing availability of drug-drug interactions (DDI) datasets and large biomedical knowledge graphs (KGs), accurate detection of adverse DDI using machine learning…

cs.SI2020★ 7 cited

STAN: Spatio-Temporal Attention Network for Pandemic Prediction Using Real World Evidence

Junyi Gao, Rakshith Sharma, Cheng Qian +5

Objective: The COVID-19 pandemic has created many challenges that need immediate attention. Various epidemiological and deep learning models have been developed to predict the COVI…

cs.LG2020★ 2 cited

COMPOSE: Cross-Modal Pseudo-Siamese Network for Patient Trial Matching

Junyi Gao, Cao Xiao, Lucas M. Glass +1

Clinical trials play important roles in drug development but often suffer from expensive, inaccurate and insufficient patient recruitment. The availability of massive electronic he…

cs.LG2020★ 13 cited

Fast Graph Attention Networks Using Effective Resistance Based Graph Sparsification

Rakshith S Srinivasa, Cao Xiao, Lucas Glass +2

The attention mechanism has demonstrated superior performance for inference over nodes in graph neural networks (GNNs), however, they result in a high computational burden during b…

q-bio.QM2020★ 678 cited

MolTrans: Molecular Interaction Transformer for Drug Target Interaction Prediction

Kexin Huang, Cao Xiao, Lucas Glass +1

Drug target interaction (DTI) prediction is a foundational task for in silico drug discovery, which is costly and time-consuming due to the need of experimental search over large d…

q-bio.MN2020★ 6 cited

SkipGNN: Predicting Molecular Interactions with Skip-Graph Networks

Kexin Huang, Cao Xiao, Lucas Glass +2

Molecular interaction networks are powerful resources for the discovery. They are increasingly used with machine learning methods to predict biologically meaningful interactions. W…

cs.LG2020★ 508 cited

DeepPurpose: a Deep Learning Library for Drug-Target Interaction Prediction

Kexin Huang, Tianfan Fu, Lucas Glass +3

Accurate prediction of drug-target interactions (DTI) is crucial for drug discovery. Recently, deep learning (DL) models for show promising performance for DTI prediction. However,…

cs.LG2020

CLARA: Clinical Report Auto-completion

Siddharth Biswal, Cao Xiao, Lucas M. Glass +2

Generating clinical reports from raw recordings such as X-rays and electroencephalogram (EEG) is an essential and routine task for doctors. However, it is often time-consuming to w…

cs.LG2020★ 79 cited

StageNet: Stage-Aware Neural Networks for Health Risk Prediction

Junyi Gao, Cao Xiao, Yasha Wang +3

Deep learning has demonstrated success in health risk prediction especially for patients with chronic and progressing conditions. Most existing works focus on learning disease Netw…