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计算化学 Skills | Skills Pool

分类计算化学

分类

计算化学

4934 个技能

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AI 推荐

4934 个技能

Medical Unit Converter

Convert medical laboratory values between units (mg/dL to mmol/L, etc.) with formula transparency and clinical reference ranges. Supports glucose, cholesterol, creatinine, and hemoglobin conversions.

Medication Reconciliation

Compare patient pre-admission medication lists with inpatient orders to automatically identify omitted or duplicated medications and improve medication safety.

Open Source License Check

Check if referenced bioinformatics software/code licenses allow commercial use (GPL vs MIT, etc.).

Reagent Expiry Alert

Scan reagent barcodes or IDs, log expiration dates, and generate multi-level alerts before reagent expiry to support laboratory inventory management.

Serial Dilution Calculator

Generate qPCR/ELISA dilution protocols with precise pipetting steps

Variant Pathogenicity Predictor

Integrate REVEL, CADD, PolyPhen scores to predict variant pathogenicity.

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Protein Struct Viz

Generate PyMOL scripts to highlight specific protein residues in PDB structures. Use this skill when the user needs to visualize specific amino acid residues, create publication-quality protein images, or highlight functional sites in protein structures.

Gui Memory

Visual memory system — split storage, component forgetting, state merging, transition dedup.

Fda Consultant Specialist

FDA regulatory consultant for medical device companies. Provides 510(k)/PMA/De Novo pathway guidance, QSR (21 CFR 820) compliance, HIPAA assessments, and device cybersecurity. Use when user mentions FDA submission, 510(k), PMA, De Novo, QSR, premarket, predicate device, substantial equivalence, HIPAA medical device, or FDA cybersecurity.

Actor Indian Hypothesis

Entity hypothesis — guess candidate Indian actors first, then verify against question constraints

EverMind-AI4.1k

Bio Chemical Numeric

Use precise chemical compound names and concentration values as exact-match search anchors for biology papers

EverMind-AI4.1k

Movie Clue Decompose

Break down complex movie constraints into independent searchable dimensions and tackle them one by one

EverMind-AI4.1k

Math Model Selector

Routes problems to appropriate mathematical frameworks using expert heuristics

Boundary Value Problems

Problem-solving strategies for boundary value problems in odes pdes

First Order Odes

Problem-solving strategies for first order odes in odes pdes

Residues

Problem-solving strategies for residues in complex analysis

Second Order Odes

Problem-solving strategies for second order odes in odes pdes

Home Security Ai Benchmark

LLM & VLM evaluation suite for home security AI applications

Homeassistant Bridge

Bidirectional Home Assistant integration — HA cameras in, detection results out

Ad Overview

Active Directory attack lane — BloodHound ingestion, Kerberoasting, ADCS ESC scanning, DCSync, LAPS extraction.

PurpleAILAB2.2k

Scanner Overview

Stage 1 broad-spectrum scanner playbook. Sharded sweep over very large codebases producing CANDIDATE nodes for the Detector to reason about. Load at scanner-agent startup.

PurpleAILAB2.2k

Judgment Day

Parallel adversarial review protocol that launches two independent blind judge sub-agents simultaneously to review the same target, synthesizes their findings, applies fixes, and re-judges until both pass or escalates after 2 iterations. Trigger: When user says "judgment day", "judgment-day", "review adversarial", "dual review", "doble review", "juzgar", "que lo juzguen".

Gentleman-Programming2.1k

Mutant

Run mutant, read mutation reports, fix alive mutations, and verify coverage. Use when running mutation testing or responding to alive mutations.

Adverse Drug Event Signal Detection & Analysis

Detect and analyze adverse drug event signals using FDA FAERS data, drug labels, disproportionality analysis (PRR, ROR, IC), and biomedical evidence. Generates quantitative safety signal scores (0-100) with evidence grading. Use for post-market surveillance, pharmacovigilance, drug safety assessment, adverse event investigation, and regulatory decision support.

FreedomIntelligence2.1k

Immunotherapy Response Prediction

Predict patient response to immune checkpoint inhibitors (ICIs) using multi-biomarker integration. Given a cancer type, somatic mutations, and optional biomarkers (TMB, PD-L1, MSI status), performs systematic analysis across 11 phases covering TMB classification, neoantigen burden estimation, MSI/MMR assessment, PD-L1 evaluation, immune microenvironment profiling, mutation-based resistance/sensitivity prediction, clinical evidence retrieval, and multi-biomarker score integration. Generates a quantitative ICI Response Score (0-100), response likelihood tier, specific ICI drug recommendations with evidence, resistance risk factors, and a monitoring plan. Use when oncologists ask about immunotherapy eligibility, checkpoint inhibitor selection, or biomarker-guided ICI treatment decisions.

FreedomIntelligence2.1k

Tooluniverse Pharmacovigilance

Analyze drug safety signals from FDA adverse event reports, label warnings, and pharmacogenomic data. Calculates disproportionality measures (PRR, ROR), identifies serious adverse events, assesses pharmacogenomic risk variants. Use when asked about drug safety, adverse events, post-market surveillance, or risk-benefit assessment.

FreedomIntelligence2.1k

Medical Research Toolkit

Query 14+ biomedical databases for drug repurposing, target discovery, clinical trials, and literature research. Access ChEMBL, PubMed, ClinicalTrials.gov, OpenTargets, OpenFDA, OMIM, Reactome, KEGG, UniProt, and more through a unified MCP endpoint. Use when researching disease targets, finding approved/investigational drugs, searching clinical evidence, discovering genetic associations, or analyzing compound bioactivity data.

FreedomIntelligence2.1k

Bio Variant Calling Clinical Interpretation

Clinical variant interpretation using ClinVar, ACMG guidelines, and pathogenicity predictors. Prioritize variants for diagnostic and research applications. Use when interpreting clinical significance of variants.

FreedomIntelligence2.1k

Bio Chipseq Differential Binding

Differential binding analysis using DiffBind. Compare ChIP-seq peaks between conditions with statistical rigor. Requires replicate samples. Outputs differentially bound regions with fold changes and p-values. Use when comparing ChIP-seq binding between conditions.

FreedomIntelligence2.1k

Version Compatibility

Identify likely causal variants within GWAS loci using SuSiE for sum of single effects regression and FINEMAP for shotgun stochastic search. Computes posterior inclusion probabilities and credible sets to prioritize variants for functional follow-up. Use when narrowing GWAS association signals to candidate causal variants or building credible sets for functional validation.

FreedomIntelligence2.1k