|
0
|
|
ATTNSOM: learning cross-isoform attention for cytochrome P450 site-of-metabolism prediction.
(academic.oup.com)
|
Kim H
…
Kang J
Bioinformatics
2026-07-01
|
#metabolism
#drug discovery
#machine learning
#prediction
|
|
0
|
|
KLaR: fusing knowledge graphs and language models for biomedical target discovery.
(academic.oup.com)
|
Jiang Y
…
Liu X
Bioinformatics
2026-07-01
|
#drug discovery
#knowledge-graphs
#link-prediction
#language-models
#biomedical informatics
|
|
0
|
|
Improving hit discovery by integrating activity cliff sensitivity into active learning.
(academic.oup.com)
|
Kim J
…
Kim S
Bioinformatics
2026-07-01
|
#active learning
#drug discovery
#structure-activity
#machine learning
|
|
0
|
|
Agentomics: an agentic system that autonomously develops novel state-of-the-art solutions for biomedical machine learning tasks.
(academic.oup.com)
|
Martinek V
…
Alexiou P
Bioinformatics
2026-07-01
|
#machine learning
#automation
#drug discovery
#genomics
#protein design
|
|
0
|
|
KASSPer: Kinase Active Site Structure Prediction using Protein and Ligand Language Models and Its Application to Virtual Screening.
(academic.oup.com)
|
Jang W
…
Shin WH
Bioinformatics
2026-07-01
|
#virtual screening
#kinase
#structure prediction
#drug discovery
#machine learning
|
|
0
|
|
Development of domain-specific probes of Plasmodium falciparum heat shock protein 70-1.
(journals.asm.org)
|
Keeler AM
…
Derbyshire ER
Antimicrobial Agents and Chemotherapy
2026-07-02
|
#malaria
#chaperone
#drug discovery
#inhibitor
#proteomics
|
|
0
|
|
3DICE: Interpretable 3D Cross-Modal Learning for Drug-Target Interaction Prediction and Large-Scale Drug Discovery.
(academic.oup.com)
|
Liu AZR
…
Chua MCH
Bioinformatics
2026-07-02
|
#drug discovery
#deep learning
#protein structure
#binding prediction
|
|
0
|
|
Advancing bioinformatics with language models: components, applications, and perspectives.
(academic.oup.com)
|
Liu J
…
Zhou X
Briefings in Bioinformatics
2026-07-03
|
#bioinformatics
#machine learning
#genomics
#proteomics
#drug discovery
|
|
0
|
|
A graph retrieval-augmented generation pipeline for systematic drug target discovery: validation and application to ocular neovascularization.
(academic.oup.com)
|
Mun Y
…
Park KH
Briefings in Bioinformatics
2026-07-03
|
#druggability
#angiogenesis
#drug discovery
#knowledge-graphs
#neovascularization
|
|
0
|
|
SA-MTP: a structure-aware framework for multifunctional therapeutic peptide annotation.
(academic.oup.com)
|
Yu W
…
Sun N
Briefings in Bioinformatics
2026-07-03
|
#peptide
#annotation
#prediction
#drug discovery
|
|
0
|
|
Investigating the anticancer activity of eravacycline in pancreatic cancer via target-based deep learning and experimental validation.
(academic.oup.com)
|
Jabarin A
…
Ben-Shabat S
Briefings in Bioinformatics
2026-07-03
|
#pancreatic cancer
#drug discovery
#deep learning
#computational-screening
#p53
|
|
0
|
|
Integration of genetic evidence to identify approved drug targets.
(link.springer.com)
|
Moix S
…
Kutalik Z
Genome Medicine
2026-07-06
|
#genome-wide association
#drug discovery
#mendelian randomization
#gene-prioritization
#qtl
|
|
0
|
|
A ligandable PNT domain establishes ERG as a directly targetable oncogenic driver in prostate cancer.
(pnas.org)
|
Wang X
…
Chinnaiyan AM
PNAS
2026-07-07
|
#oncogene
#drug discovery
#prostate cancer
#transcription-factors
#structural biology
|
|
0
|
|
RLAnOxPeptide: An Integrated Framework Combining Transformer and reinforcement learning for Efficient Antioxidant Peptide Prediction and Innovative Design.
(academic.oup.com)
|
Han C
…
Wang Y
Bioinformatics
2026-07-08
|
#peptide
#antioxidant
#de-novo-design
#machine learning
#drug discovery
|
|
0
|
|
Autonomous biomedical research with an artificial intelligence agent.
(science.org)
|
Huang K
…
Leskovec J
Science
2026-07-09
|
#automation
#ai
#bioinformatics
#drug discovery
#microbiome
|
|
0
|
|
AI-guided identification of natural CTSL inhibitors with therapeutic potential for renal injury.
(journals.plos.org)
|
Ma F
…
Yang JK
PLOS Computational Biology
2026-07-10
|
#drug discovery
#natural products
#nephrology
#protease-inhibition
#molecular docking
|
|
0
|
|
Navigating chemical-linguistic sharing space with heterogeneous molecular encoding.
(nature.com)
|
Lv L
…
Tian Y
Nature Communications
2026-07-10
|
#molecular design
#language-models
#chemical-informatics
#drug discovery
|
|
0
|
|
Molecular imaging-guided discovery of a potent natural FAPalpha inhibitor for liver fibrosis therapy.
(nature.com)
|
Zhang W
…
Tian J
Nature Communications
2026-07-11
|
#fibrosis
#imaging
#drug discovery
#inhibitor
|