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npj Drug Discovery - ResearchHub

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Journal

npj Drug Discovery

3005-1452 · Springer Science and Business Media LLC

73 verified public works

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Personalized drug discovery from rare diseases to cancer

2026 · 0 citations

Harnessing snake venom cardiotoxins for antimicrobial peptide discovery

2026 · 0 citations

RUNX2 inhibitor CADD522 improves bone microarchitecture and lipid metabolism in post-menopausal bone loss

2026 · 0 citations

Closing the recapitulation gap in obesity-conditioned TNBC drug development

2026 · 0 citations

Discovery and preclinical validation of a translationally optimized mitochondrial complex I modulator for Alzheimer’s disease

2026 · 0 citations

Pushing the boundaries of virtual screening scale of combinatorial spaces with the V-SYNTHES approach

2026 · 0 citations

Considerations for the dynamic role of bile acids during oral drug discovery and development

2026 · 0 citations

Data driven selection of consensus docking pipelines for structure based hit identification

2026 · 0 citations

A curated benchmark for cofolding models on kinase conformational states

2026 · 0 citations

Publisher Correction: FeatureDock for protein-ligand docking guided by physicochemical feature-based local environment learning using transformer

2026 · 0 citations

New paradigm of q-CAR drug development targeting disease-specific protein conformations

2026 · 0 citations

Induced proximity-based therapeutics for advanced prostate cancer

2026 · 0 citations

Triple potentiator combinations increase the functional correction of several CFTR gating mutants

2026 · 0 citations

On the generalization and usability of cofolding models for GPCR drug discovery

2026 · 0 citations

Structure-based TCR-pMHC binding prediction and generalization to unseen peptides

2026 · 0 citations

Ubiquitin family as novel protein partners for molecular glues

2026 · 0 citations

Diversity Beats Size Scaling for Chemical Language Models

2026 · 0 citations

A novel small molecule remyelination therapy for multiple sclerosis

2026 · 0 citations

Prioritizing neuroactive ligands using motif-guided virtual discovery and zebrafish profiling

2026 · 0 citations

Targeting druggable kinases in neuropathic pain

2026 · 0 citations

Efficient and valid large molecule generation via self-supervised generative models

2026 · 0 citations

Generative AI for controllable protein sequence design: A survey

2026 · 0 citations

V-SYNTHES2—the next generation tool for structure-based virtual screening of giga-scale chemical spaces

2026 · 0 citations

Assessing the ligand native-like pose using a quantum mechanical-derived hydropathic score for protein-ligand complementarity

2026 · 0 citations

Spider venom peptides Ht1a and Gg1a are toxic to honeybee parasite Varroa destructor by topical application

2026 · 0 citations

Mechanistic and therapeutic insights into class A GPCR dimers in neuropsychiatric disorders

2026 · 0 citations

Deep learning-driven integrated pipeline for de novo design and synthesis of antimicrobial peptides

2026 · 0 citations

MAMMAL - Molecular Aligned Multi-Modal Architecture and Language for biomedical discovery

2026 · 0 citations

Accelerating GPCR drug discovery through computation and experiment integrated with direct detection of ligand binding events

2026 · 0 citations

A Metabolism-Informed Neural Network Identifies Pathways Influencing the Potency and Toxicity of Antimicrobial Combinations

2026 · 0 citations

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