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  • Molecular ccs prediction model training

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-ccs-prediction-model-training Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular cheminformatics pipeline

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-cheminformatics-pipeline Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular class annotation for networks

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-class-annotation-for-networks Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular complexity metric computation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-complexity-metric-computation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular conformer generation and optimization

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-conformer-generation-and-optimization Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular conformer preprocessing

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-conformer-preprocessing Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular connectivity inference

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-connectivity-inference Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular coordinate generation 2d3d

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-coordinate-generation-2d3d Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular database loading and parsing

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-database-loading-and-parsing Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular dataset partitioning and preprocessing

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-dataset-partitioning-and-preprocessing Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor calculation via rdkit

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-calculation-via-rdkit Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor calculation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-calculation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor computation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-computation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor extraction

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-extraction Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor fingerprint generation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-fingerprint-generation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor generation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-generation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor graph representation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-graph-representation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor indexing

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-indexing Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular descriptor interpretation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-descriptor-interpretation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular duplicate detection and deduplication

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-duplicate-detection-and-deduplication Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular embedding generation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-embedding-generation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular embedding inference

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-embedding-inference Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular family graph construction

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-family-graph-construction Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular family grouping analysis

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-family-grouping-analysis Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular feature engineering

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-feature-engineering Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint bit frequency analysis

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-bit-frequency-analysis Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint calculation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-calculation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint computation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-computation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint extraction and vectorization

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-extraction-and-vectorization Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint generation and encoding

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-generation-and-encoding Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint generation rdk

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-generation-rdk Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint generation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-generation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint parsing

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-parsing Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint prediction

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-prediction Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint representation learning

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-representation-learning Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fingerprint structural similarity tanimoto

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fingerprint-structural-similarity-tanimoto Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular format conversion

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-format-conversion Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula assignment and validation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-assignment-and-validation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula assignment

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-assignment Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula calculation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-calculation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula computation from structure

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-computation-from-structure Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula database filtering

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-database-filtering Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula heteroatom classification

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-heteroatom-classification Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula inference from adducts

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-inference-from-adducts Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula isotopic profile matching

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-isotopic-profile-matching Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula parsing and validation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-parsing-and-validation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula parsing from smiles

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-parsing-from-smiles Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula prediction from fragmentation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-prediction-from-fragmentation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula prediction

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-prediction Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula property derivation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-property-derivation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula quality assessment

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-quality-assessment Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula representation and manipulation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-representation-and-manipulation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula search assignment

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-search-assignment Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula to carbon count extraction

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-to-carbon-count-extraction Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular formula validation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-formula-validation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fragment assembly from transformer predictions

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fragment-assembly-from-transformer-predictions Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fragment prediction interpretation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fragment-prediction-interpretation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular fragment prediction

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-fragment-prediction Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular geometry file parsing

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-geometry-file-parsing Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder

  • Molecular geometry neural network potential evaluation

    HolobiomicsLab/asb-skill-collections/collections/metabolomics/v2/skills/molecular-geometry-neural-network-potential-evaluation Skill

    15★ repo

    Curated, evidence-grounded skill and software-tool collections for scientific AI agents, generated by the AgenticScienceBuilder