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Computational Biology

371 items from inoue0426/awesome-computational-biology ★159

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    Broad Institute Single Cell Portal singlecell.broadinstitute.org

    Reducing barriers and accelerating single-cell research.

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    UCSC Genome Browser genome.ucsc.edu

    Interactively visualize genomic data.

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    Ensembl ensembl.org

    A genome browser for vertebrate genomes that supports research in comparative genomics, evolution, sequence variation and transcriptional regulation.

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    EBI Single Cell Expression Atlas ebi.ac.uk

    Single cell gene expression across species.

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    cBioPortal for Cancer Genomics cbioportal.org

    Visualization, analysis and download of large-scale cancer genomics data sets.

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    OpenMM openmm.org

    High-performance toolkit for molecular simulation and GPU-accelerated MD.

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    Gromacs gromacs.org

    Molecular dynamics simulation package for biochemical molecules.

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    GenBank ncbi.nlm.nih.gov

    NCBI's database of genetic sequences.

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    UK Biobank ukbiobank.ac.uk

    A large-scale biomedical database and research resource with 500,000 research participants.

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    Comparative Toxicogenomics Database ctdbase.org

    paper - A database of manually curated associations between chemicals, gene products, phenotypes, diseases, and environmental exposures. Useful for assembling ontologies of the related concepts, such as types of chemicals.

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    Biopython biopython.org

    paper - code - Python tools primarily intended for bioinformatics and computational molecular biology purposes, but also a convenient way to obtain data, including documents/abstracts from PubMed (see Chapter 9 of the documentation).

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    ZINC ligand discovery database zinc.docking.org

    Free database of commercially-available compounds for virtual screening.

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    WikiPathways wikipathways.org

    Database of biological pathways.

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    UniRef uniprot.org

    Non-redundant sequence database clustering UniProtKB entries at multiple sequence identity thresholds.

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    UniProt REST API uniprot.org

    Programmatic access to protein sequence and functional annotation data.

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    UniProt uniprot.org

    Functional information on proteins.

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    Uniclust uniclust.mmseqs.com

    Clustered protein sequence databases.

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    Tox21 tripod.nih.gov

    12,707 compounds tested in 12 nuclear receptor and stress-response pathway biochemical assays for toxicity prediction.

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    BioGRID thebiogrid.org

    Protein, genetic, and chemical interactions.

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    ClinTox tdcommons.ai

    Clinical toxicity dataset contrasting FDA-approved drugs with those that failed clinical trials due to toxicity.

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    Therapeutics Data Commons (TDC) tdcommons.ai

    Unified benchmark suite covering ADMET, drug-target interaction, drug response, and more.

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    Tabula Sapiens tabula-sapiens-portal.ds.czbiohub.org

    Comprehensive human single-cell atlas of ~500K cells from 24 organs and tissues across multiple donors.

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    Tabula Muris tabula-muris.ds.czbiohub.org

    Comprehensive single-cell atlas of 20 mouse organs and tissues, enabling cross-tissue and cross-species comparisons.

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    STRING string-db.org

    PPI networks for multiple organisms.

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    STITCH stitch.embl.de

    Chemical-protein interactions.

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    Davis kinase inhibitors DB staff.cs.utu.fi

    Experimental kinase inhibitor binding affinity dataset for protein–ligand interaction research.

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    Squidpy squidpy.readthedocs.io

    Python library for spatial single-cell analysis.

  28. 0
    SNAP snap.stanford.edu

    Dataset of drug-gene interactions.

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    Cancer Cell Line Encyclopedia sites.broadinstitute.org

    Database of ~1000 cancer cell lines.

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    Frangieh et al. 2021 Perturb-CITE-seq singlecell.broadinstitute.org

    Multimodal CRISPR knockout screen with RNA and surface-protein readouts in patient-derived melanoma models under immune-related conditions.

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