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Science Comp.

Simulation and numerical analysis.

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scientific-computing
453

deep-research

Conducts enterprise-grade research with multi-source synthesis, citation tracking, and verification. Produces citation-backed reports through a structured pipeline with source credibility scoring. Triggers on "deep research", "comprehensive analysis", "research report", "compare X vs Y", "analyze trends", or "state of the art". Not for simple lookups, debugging, or questions answerable with 1-2 searches.

199-biotechnologies
199-biotechnologies
research
open
scientific-computing
448

schema

Schema storage and discovery in Graph Explorer, including SchemaStorageModel persistence, edge connections, incremental schema growth, and related Jotai atoms.

aws
aws
research
open
scientific-computing
438

skill-researcher

Conduct general research using web search, documentation, and codebase exploration. Invoke for general research tasks.

benbrastmckie
benbrastmckie
research
open
scientific-computing
438

skill-researcher

Conduct general research using web search, documentation, and codebase exploration. Invoke for general research tasks.

benbrastmckie
benbrastmckie
research
open
scientific-computing
432

skill-researcher

Conduct general research using web search, documentation, and codebase exploration. Invoke for non-Lean research tasks.

benbrastmckie
benbrastmckie
research
open
scientific-computing
411

clinical-decision-support

Generate professional clinical decision support (CDS) documents for pharmaceutical and clinical research settings, including patient cohort analyses (biomarker-stratified with outcomes) and treatment recommendation reports (evidence-based guidelines with decision algorithms). Supports GRADE evidence grading, statistical analysis (hazard ratios, survival curves, waterfall plots), biomarker integration, and regulatory compliance. Outputs publication-ready LaTeX/PDF format optimized for drug development, clinical research, and evidence synthesis.

K-Dense-AI
K-Dense-AI
research
open
scientific-computing
411

scientific-writing

Core skill for the deep research and writing tool. Write scientific manuscripts in full paragraphs (never bullet points). Use two-stage process: (1) create section outlines with key points using research-lookup, (2) convert to flowing prose. IMRAD structure, citations (APA/AMA/Vancouver), figures/tables, reporting guidelines (CONSORT/STROBE/PRISMA), for research papers and journal submissions.

K-Dense-AI
K-Dense-AI
research
open
scientific-computing
411

hypothesis-generation

Generate testable hypotheses. Formulate from observations, design experiments, explore competing explanations, develop predictions, propose mechanisms, for scientific inquiry across domains.

K-Dense-AI
K-Dense-AI
research
open
scientific-computing
395

tooluniverse

Use this skill when working with scientific research tools and workflows across bioinformatics, cheminformatics, genomics, structural biology, proteomics, and drug discovery. This skill provides access to 600+ scientific tools including machine learning models, datasets, APIs, and analysis packages. Use when searching for scientific tools, executing computational biology workflows, composing multi-step research pipelines, accessing databases like OpenTargets/PubChem/UniProt/PDB/ChEMBL, performing tool discovery for research tasks, or integrating scientific computational resources into LLM workflows.

jimmc414
jimmc414
research
open
scientific-computing
371

aliphatic-ring-analysis

Ring System Analysis - Analyze ring systems: count aliphatic carbocycles, analyze aromaticity, compute topology, and structure complexity. Use this skill for organic chemistry tasks involving GetAliphaticCarbocyclesNum AromaticityAnalyzer calculate mol topology calculate mol structure complexity. Combines 4 tools from 3 SCP server(s).

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

smiles-comprehensive-analysis

SMILES Comprehensive Analysis - Comprehensive SMILES analysis: validate, convert name, compute all molecular descriptors, and predict ADMET. Use this skill for cheminformatics tasks involving is valid smiles ChemicalStructureAnalyzer calculate mol basic info pred molecule admet. Combines 4 tools from 3 SCP server(s).

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

chembl-molecule-search

Search ChEMBL database for molecule information by name to retrieve bioactivity data and chemical structures.

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

protein-property-comparison

Cross-Species Protein Comparison - Compare proteins across species: get orthologs from NCBI, compute properties for each, and compare similarity. Use this skill for comparative biology tasks involving get gene orthologs calculate protein sequence properties calculate smiles similarity get homology id. Combines 4 tools from 3 SCP server(s).

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

signal-processing

Signal Processing Analysis - Analyze signals: duty cycle, frequency range, electron wavelength, and measurement error analysis. Use this skill for signal processing tasks involving calculate duty cycle calculate frequency range electron wavelength calculate absolute error. Combines 4 tools from 3 SCP server(s).

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

protein-properties-calculation

Calculate comprehensive protein sequence properties including isoelectric point, molecular weight, hydrophobicity, and physicochemical parameters.

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

thermal-analysis

Thermal & Heat Transfer Analysis - Analyze thermal system: calculate heat released, convert energy units, compute potential energy, and dynamic viscosity. Use this skill for thermal engineering tasks involving calculate heat released convert energy MeV to J calculate potential energy calculate dynamic viscosity. Combines 4 tools from 1 SCP server(s).

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

drugsda-prosst

Given a protein sequence and its structure, employ ProSST model to predict mutation effects and obtain the top-k mutated sequences.

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

drugsda-linker-sampling

Generate new molecules sampling from the input two warhead fragments.

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

drugsda-mol-properties

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 metrics, respectively.

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

drug-metabolism-study

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 compound by name get clinical pharmacology by drug name. Combines 4 tools from 3 SCP server(s).

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

drugsda-data-valid

Check if the input protein sequence or molecule SMILES string is valid.

SpectrAI-Initiative
SpectrAI-Initiative
research
open
scientific-computing
371

chemical-structure-analysis

Analyze chemical structures from compound names to retrieve SMILES, molecular formulas, molecular weight, and LogP values.

SpectrAI-Initiative
SpectrAI-Initiative
research
open
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