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SkillsMP a collecté 221 skills depuis SpectrAI-Initiative/InnoClaw. Ouvrez un skill pour examiner sa source et ses détails.
SpectrAI-Initiative/InnoClawAffichage de 40 skills collectés sur 221.
Compound-to-Drug Analysis Pipeline - Full compound-to-drug pipeline: name-to-SMILES conversion, structure analysis, drug-likeness, and FDA drug lookup. Use this skill for drug development tasks involving NameToSMILES ChemicalStructureAnalyzer calculate mol…
Langue du texte source : anglais
Comprehensive protein analysis combining InterProScan domain identification with BLAST similarity search to provide complete functional and evolutionary annotation.
Langue du texte source : anglais
Given an rsID, query multiple databases (dbSNP, FAVOR, GWAS Catalog, ClinVar, gnomAD, PharmGKB, ClinGen) for comprehensive annotation. Use when user asks a general question about a variant without specifying which aspect.
Langue du texte source : anglais
Cross-Species Comparative Genomics - Compare genomes across species: Ensembl compara, alignment, gene trees, and NCBI taxonomy. Use this skill for comparative genomics tasks involving get info compara species sets get alignment region get genetree member…
Langue du texte source : anglais
Disease-Specific Compound Screening - Screen compounds for disease: get DLEPS score for disease relevance, predict ADMET, and check drug-likeness. Use this skill for drug discovery tasks involving calculate dleps score pred molecule admet calculate mol drug…
Langue du texte source : anglais
Disease-Drug Landscape Analysis - Map the drug landscape for a disease: OpenTargets disease drugs, FDA indications, and clinical studies. Use this skill for drug discovery tasks involving get associated drugs by target name get drug names by indication get…
Langue du texte source : anglais
Disease Knowledge Graph - Build disease knowledge graph: OpenTargets targets, drugs, publications, and phenotypes. Use this skill for disease informatics tasks involving get associated targets by disease efoId get associated drugs by target name get…
Langue du texte source : anglais
Disease Protein Profiling - Profile a disease protein: UniProt data, AlphaFold structure, InterPro domains, phenotype associations from Ensembl. Use this skill for medical proteomics tasks involving query uniprot download alphafold structure query interpro…
Langue du texte source : anglais
Predict a molecule's ability to reverse disease states using DLEPS (Disease-Ligand Embedding Projection Score) for drug repositioning and discovery.
Langue du texte source : anglais
Analyze DNA and RNA sequences including molecular weight calculation, reverse complement generation, and oligonucleotide properties.
Langue du texte source : anglais
Drug-Indication Mapping - Map drug indications: ChEMBL drug indications, FDA indications, OpenTargets drug associations, and literature. Use this skill for clinical informatics tasks involving get drug indication by id get indications by drug name get…
Langue du texte source : anglais
Drug-Drug Interaction Checker - Check interactions between multiple drugs using FDA interaction data, PubChem compound info, and ChEMBL target overlap analysis. Use this skill for clinical pharmacology tasks involving get drug interactions by drug name get…
Langue du texte source : anglais
Drug Metabolism Study - Study drug metabolism: FDA metabolism data, ChEMBL metabolism records, PubChem compound data, and clinical pharmacology. Use this skill for drug metabolism tasks involving get metabolism by id get pharmacokinetics by drug name get…
Langue du texte source : anglais
Drug Repurposing Screening - Screen existing drugs for new indications by querying FDA indications, ChEMBL mechanisms, and OpenTargets drug-disease associations. Use this skill for drug discovery tasks involving get indications by drug name get mechanism of…
Langue du texte source : anglais
Comprehensive Drug Safety Profile - Build a complete drug safety profile by combining FDA adverse reactions, boxed warnings, drug interactions, and contraindications. Use this skill for pharmacology tasks involving get adverse reactions by drug name get boxed…
Langue du texte source : anglais
Comprehensive drug screening pipeline from molecular filtering through QED/ADMET criteria to protein-ligand docking, identifying promising drug candidates.
Langue du texte source : anglais
Drug Target Identification Pipeline - Identify drug targets for a disease by querying OpenTargets for associated targets, then retrieve detailed target info from ChEMBL and protein data from UniProt. Use this skill for drug discovery tasks involving get…
Langue du texte source : anglais
Drug-Target Structural Biology - Integrate drug and target structure: get drug from ChEMBL, target structure from PDB, dock them, and predict ADMET. Use this skill for structural pharmacology tasks involving get drug by name retrieve protein data by pdbcode…
Langue du texte source : anglais
Drug Warning Intelligence Report - Generate drug warning report: ChEMBL drug warnings, FDA boxed warnings, adverse reactions, and environmental warnings. Use this skill for pharmacovigilance tasks involving get drug warning by id get boxed warning info by…
Langue du texte source : anglais
Predict the ADMET (absorption, distribution, metabolism, excretion, and toxicity) properties of the input molecules.
Langue du texte source : anglais
Retrieve SMILES strings from PubChem using compound names.
Langue du texte source : anglais
Check if the input protein sequence or molecule SMILES string is valid.
Langue du texte source : anglais
Generate new molecules de novo.
Langue du texte source : anglais
Calculate disease reversal scores for the provided molecules relative to a specific disease.
Langue du texte source : anglais
Compute the drug-likeness metrics (QED score and Number of violations of Lipinski's Rule of Five) of the input candidate molecules (SMILES format).
Langue du texte source : anglais
Use ESMFold model to predict 3D structure of the input protein sequence.
Langue du texte source : anglais
Implement data transmission between the local computer and the MCP Server using Base64 encoding
Langue du texte source : anglais
Generate new molecules sampling from the input two warhead fragments.
Langue du texte source : anglais
Calculate different types of molecular properties based on SMILES strings, covering basic physicochemical properties, hydrophobicity, hydrogen bonding capability, molecular complexity, topological structures, charge distribution, and custom complexity…
Langue du texte source : anglais
Compute the Tanimoto similarities between a target molecule and a list of candidate molecules using Morgan fingerprints.
Langue du texte source : anglais
Generate new molecules sampling from the input molecule.
Langue du texte source : anglais
license: MIT license
Langue du texte source : anglais
Generate new peptide molecules sampling from the input peptide sequence.
Langue du texte source : anglais
Given a protein sequence and its structure, employ ProSST model to predict mutation effects and obtain the top-k mutated sequences.
Langue du texte source : anglais
Generate new molecules sampling from the input scaffold.
Langue du texte source : anglais
Search the protein information from the input gene name and downloads the optimal PDB or AlphaFold structures.
Langue du texte source : anglais
Electrical Circuit Analysis - Analyze electrical circuit: compute capacitance, convert resistance units, calculate total charge, and duty cycle. Use this skill for electrical engineering tasks involving convert resistance kOhm to Ohm calculate geometric term…
Langue du texte source : anglais
Electromagnetic Field Analysis - Analyze EM fields: vacuum permittivity, total charge, radiation pressure, and photon calculations. Use this skill for electromagnetics tasks involving calculate vacuum permittivity calculate total charge calculate radiation…
Langue du texte source : anglais
Energy Unit Conversion Pipeline - Convert between energy units and analyze: MeV to Joules, scientific notation, and error calculation. Use this skill for physics tasks involving convert energy MeV to J convert to scientific notation format scientific notation…
Langue du texte source : anglais
Retrieve genomic sequences from Ensembl database using transcript or gene IDs to obtain nucleotide and protein sequences.
Langue du texte source : anglais