All Stories

  1. ECLIPSE: Exploration of Complex Ligand-Protein Interactions through Learning from Systems-level Heterogeneous Biomedical Knowledge Graphs
  2. Mpox: disease manifestations and therapeutic development
  3. Molecular Contrastive Learning with Graph Attention Network (MoCL-GAT) for Enhanced Molecular Representation
  4. Target-specific de novo design of drug candidate molecules with graph-transformer-based generative adversarial networks
  5. ProtHGT: Heterogeneous Graph Transformers for Automated Protein Function Prediction Using Biological Knowledge Graphs and Language Models
  6. A Benchmarking Platform for Assessing Protein Language Models on Function-related Prediction Tasks
  7. Protein language models for predicting drug–target interactions: Novel approaches, emerging methods, and future directions
  8. A Benchmarking Platform for Assessing Protein Language Models on Function-Related Prediction Tasks
  9. Design, synthesis, and evaluation of novel Indole‐Based small molecules as sirtuin inhibitors with anticancer activities
  10. Mutual annotation‐based prediction of protein domain functions with Domain2GO
  11. Democratizing knowledge representation with BioCypher
  12. SELFormer: molecular representation learning via SELFIES language models
  13. Transfer learning for drug–target interaction prediction
  14. How to approach machine learning-based prediction of drug/compound–target interactions
  15. ProFAB—open protein functional annotation benchmark
  16. ASCARIS: Positional feature annotation and protein structure-based representation of single amino acid variations
  17. Machine learning-based prediction of drug approvals using molecular, physicochemical, clinical trial, and patent-related features
  18. UniProt: the Universal Protein Knowledgebase in 2023
  19. ASCARIS: Positional Feature Annotation and Protein Structure-Based Representation of Single Amino Acid Variations
  20. Mutual Annotation-Based Prediction of Protein Domain Functions with Domain2GO
  21. SLPred: a multi-view subcellular localization prediction tool for multi-location human proteins
  22. How to Best Represent Proteins in Machine Learning-based Prediction of Drug/Compound-Target Interactions
  23. Learning functional properties of proteins with language models
  24. A crowdsourcing open platform for literature curation in UniProt
  25. Editorial: Machine Learning Methodologies to Study Molecular Interactions
  26. Data Centric Molecular Analysis and Evaluation of Hepatocellular Carcinoma Therapeutics Using Machine Intelligence-Based Tools
  27. Protein domain-based prediction of drug/compound–target interactions and experimental validation on LIM kinases
  28. CROssBAR: comprehensive resource of biomedical relations with knowledge graph representations
  29. Protein Domain-Based Prediction of Compound–Target Interactions and Experimental Validation on LIM Kinases
  30. Crowdsourced mapping of unexplored target space of kinase inhibitors
  31. MDeePred: novel multi-channel protein featurization for deep learning-based binding affinity prediction in drug discovery
  32. UniProt: the universal protein knowledgebase in 2021
  33. Evaluation of Methods for Protein Representation Learning: A Quantitative Analysis
  34. CROssBAR: Comprehensive Resource of Biomedical Relations with Deep Learning Applications and Knowledge Graph Representations
  35. iBioProVis: interactive visualization and analysis of compound bioactivity space
  36. DEEPScreen: high performance drug–target interaction prediction with convolutional neural networks using 2-D structural compound representations
  37. The CAFA challenge reports improved protein function prediction and new functional annotations for hundreds of genes through experimental screens
  38. FAIR adoption, assessment and challenges at UniProt
  39. The CAFA challenge reports improved protein function prediction and new functional annotations for hundreds of genes through experimental screens
  40. DEEPred: Automated Protein Function Prediction with Multi-task Feed-forward Deep Neural Networks
  41. DEEPScreen: High Performance Drug-Target Interaction Prediction with Convolutional Neural Networks Using 2-D Structural Compound Representations
  42. ECPred: a tool for the prediction of the enzymatic functions of protein sequences based on the EC nomenclature
  43. HPO2GO: prediction of human phenotype ontology term associations for proteins using cross ontology annotation co-occurrences
  44. Recent applications of deep learning and machine intelligence on in silico drug discovery: methods, tools and databases
  45. HPO2GO: prediction of human phenotype ontology term associations using cross ontology annotation co-occurrences
  46. A Structural Perspective on the Modulation of Protein-Protein Interactions with Small Molecules
  47. HPO2GO: prediction of human phenotype ontology term associations using cross ontology annotation co-occurrences
  48. HPO2GO: prediction of human phenotype ontology term associations using cross ontology annotation co-occurrences
  49. Phylogenetic and Other Conservation-Based Approaches to Predict Protein Functional Sites
  50. Large-scale automated protein function prediction and an experimental validation
  51. From the research laboratory to the database: the Caenorhabditis elegans kinome in UniProtKB
  52. UniProt: the universal protein knowledgebase
  53. An expanded evaluation of protein function prediction methods shows an improvement in accuracy
  54. UniProt Tools
  55. UniProt-DAAC: domain architecture alignment and classification, a new method for automatic functional annotation in UniProtKB
  56. The UniProtKB guide to the human proteome
  57. Tools and data services registry: a community effort to document bioinformatics resources
  58. Unsupervised identification of redundant domain entries in InterPro database using clustering techniques
  59. UniProt: a hub for protein information
  60. Activities at the Universal Protein Resource (UniProt)
  61. Automatic Identification of Highly Conserved Family Regions and Relationships in Genome Wide Datasets Including Remote Protein Sequences
  62. 2-D Thresholding of the Connectivity Map Following the Multiple Sequence Alignments of Diverse Datasets
  63. Evolutionary relationships between gene sequences via nonlinear embedding