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gozsari/README.md

Hi, I'm Gökhan Özsarı

Typing SVG


About Me

I'm a Research Engineer and Data Engineer with over 10 years of experience across academia and research infrastructure. I currently contribute to large-scale life science data projects at Chalmers e-Commons and SciLifeLab Data Centre.

Research interests:

  • Machine Learning & Deep Learning (especially for bioinformatics)
    • Graph Neural Networks
    • Explainability
    • Transfer Learning
  • MLOps and scalable data pipelines
  • Open Science and FAIR data principles
  • Research tooling and infrastructure
  • Education and training in data science and machine learning

Skills & Technologies

CategoryTechnologies
LanguagesPythonJavaC++C
Data Science & ML / DLPyTorchTensorFlowScikit‑learnJupyterPyTorch GeometricmodAL
ExplainabilitySHAPLIMECaptum
MLOps & Experiment TrackingMLflowW&BOptuna
Web & API DevelopmentFlaskStreamlitGradio
Containers, Orchestration & AutomationDockerKubernetesAnsible
DatabasesPostgreSQLNeo4j
Version Control & CI/CDGitGitHubGitHub Actions
OtherKeycloakLocust

Featured Repositories

ProjectDescriptionLinks
PocketDockA web-based platform that predicts druggable binding pockets, docks single ligands or whole libraries.GitHub · Docs
DTA-GNNTarget-specific drug-target affinity dataset builder & GNN trainerPaper · Docs
SLPredSubcellular localization predictor using multi-view learningPaper · Website
CAPIMCatalytic activity and site prediction in multimer proteinsPaper · Website
ProtFeatProtein feature extraction tool for bioinformatics pipelinesGitHub
Awesome GNN Drug DiscoveryCurated list of GNN-based drug discovery resourcesGitHub

Tutorials

Hands-on tutorials to help you get started with various tools and technologies.


GitHub Stats

GitHub StatsTop LanguagesGitHub Streak


Let's Connect

LinkedInGoogle ScholarEmailChalmers Email


Profile views

Thanks for stopping by! Feel free to explore my repos or reach out for collaboration.

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  1. PocketDockPocketDockPublic

    All-in-one web platform for protein pocket prediction, ligand docking, ADMET profiling, and MM-GBSA rescoring — powered by P2Rank, AutoDock Vina, RDKit, and OpenMM.

    Python

  2. DTA-GNNDTA-GNNPublic

    Build leakage-free Drug-Target Affinity datasets from ChEMBL and train Graph Neural Networks for target-specific binding affinity prediction

    Python 3 1

  3. SLPredSLPredPublic

    a tool for subcellular localization prediction of human proteins

    Python 3

  4. Awesome-GNN-based-drug-discoveryAwesome-GNN-based-drug-discoveryPublic

    This is a curated list of research papers, resources and tools related to using Graph Neural Networks (GNNs) for drug discovery.

    64 11

  5. ProtFeatProtFeatPublic

    ProtFeat is protein feature extraction tool that utilizes POSSUM and iFeature.

    Python 20 3

  6. Single-Cell-Data-AnalysisSingle-Cell-Data-AnalysisPublic

    Notes and studies about single-cell RNA-Seq analysis

    Python 9 4