Latest Research in Machine Learning in Bioinformatics

11 research papers · 2026 median publication year

Top Research Topics in Machine Learning in Bioinformatics

Highest-Cited Papers

  1. Explainable Artificial Intelligence to Unveil Patterns of Antioxidant Peptides for Free Radical Regulation
  2. G-screen: scalable protein-aware virtual screening through flexible ligand alignment
  3. STELLAR: A Fragment-Based Docking Workflow for Highly Flexible Long-Chain Biopolymers
  4. SaltyMeta: a curated benchmark and protein language model-informed web tool for salty peptide prediction
  5. MIRAGE: Measuring Interpolation and Redundancy in Affinity GEneralization
  6. Predicting the Post-translational Modification Effects on Protein−Ligand Interactions via End-Point Binding Free Energy Calculation: Database Creation and Strategy Optimization
  7. Partner-aware Peptide-Protein Interaction Prediction and Target-conditioned Peptide Generation
  8. Molecular Dynamics Simulations in Modern Medicinal Chemistry
  9. Evaluating molecular docking for binding affinity predictions: a systematic analysis of key parameters and the utility of AlphaFold2 structures for the Schrödinger dataset
  10. Data-centric training enables meaningful interaction learning in protein-ligand binding affinity prediction
  11. Beyond second-long trajectory of the Trp-cage peptide generated using a Kinetic Monte Carlo model derived from molecular dynamics
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L3 Region - - 2026 Sep Q3

Machine Learning in Bioinformatics

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