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Results for “computational-chemistry

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Showing 1-16 of 30 ranked candidates matching "computational-chemistry"

Best blend of relevance, quality, freshness, and verified outcomes

1

Computational Chemistry Agent Skills

VERIFIEDEXCELLENT · 88TRUST · 86SAFE · REVIEWEDRESEARCH

Agent skills to run computational-chemistry tasks, used in OpenClaw

$ npx skills add jinzhezenggroup/computational-chemistry-agent-skills
128 stars59 quality86 trustReviewedClaude Code5d since pushSafe to try

Scenario RAG and knowledge

Claude Code + CLI · 4 targets

python
by jinzhezenggroupDetailsQuick view
2

Computational Thinking

VERIFIEDEXCELLENT · 85TRUST · 83SAFE · REVIEWEDEDUCATION

Course 18.S191 at MIT, Fall 2022 - Introduction to computational thinking with Julia

$ npx skills add mitmath/computational-thinking
2.8K stars59 quality83 trustReviewed4mo since pushSafe to try

Scenario Education and tutoring

CLI + Codex · 4 targets

juliaeducation
by mitmathDetailsQuick view
3

Catgo LRG

STRONG · 73TRUST · 78SAFE · REVIEWEDCODING

AI-driven workbench for computational materials science — interactive 3D structure viewer, natural-language CatBot assistant, visual DAG workflow engine, HPC job submiss…

$ npx skills add Hello-QM/catgo-LRG
168 stars46 quality78 trustReviewed with permission notes1mo since pushNeeds review

Scenario GitHub automation

CLI + Codex · 4 targets

typescriptllm
by Hello-QMDetailsQuick view
4

Cs Video Courses

VERIFIEDEXCELLENT · 100TRUST · 85SAFE · REVIEWEDCODING

List of Computer Science courses with video lectures.

$ npx skills add Developer-Y/cs-video-courses
81.8K stars75 quality85 trustReviewed with permission notes2mo since pushNeeds review

Scenario Coding agents

CLI + Codex · 4 targets

machine-learning
by Developer-YDetailsQuick view
5

Ad Papers

VERIFIEDSTRONG · 71TRUST · 78SAFE · REVIEWEDDESIGN

Papers on Computational Advertising

$ npx skills add wzhe06/Ad-papers
4.4K stars52 quality78 trustReviewed with permission notes6y since pushNeeds review

Scenario Multimodal media

CLI + Codex · 4 targets

pythonmachine-learning
by wzhe06DetailsQuick view
6

ChemGraph

PROMISING · 66TRUST · 76SAFE · REVIEWEDCODING

Agentic framework for computational chemistry and materials science workflows

$ npx skills add argonne-lcf/ChemGraph
122 stars45 quality76 trustReviewed with permission notes2mo since pushNeeds review

Scenario GitHub automation

CLI + Codex · 4 targets

pythonllm
by argonne-lcfDetailsQuick view
7

Biotite

STRONG · 75TRUST · 79SAFE · REVIEWEDCODING

A comprehensive library for computational molecular biology

$ npx skills add biotite-dev/biotite
958 stars52 quality79 trustReviewed with permission notes2mo since pushSafe to try

Scenario GitHub automation

CLI + Codex · 4 targets

pythonbioinformatics
by biotite-devDetailsQuick view
8

Cdk

STRONG · 73TRUST · 79SAFE · REVIEWEDCODING

The Chemistry Development Kit

$ npx skills add cdk/cdk
585 stars50 quality79 trustReviewed with permission notes2mo since pushNeeds review

Scenario GitHub automation

CLI + Codex · 4 targets

javabioinformatics
by cdkDetailsQuick view
9

AISP

NEEDS REVIEW · 43TRUST · 71SAFE · EXPERIMENTALCODING

AI Image Signal Processing and Computational Photography. Official library for NTIRE (CVPR) and AIM (ICCV/ECCV) Challenges. You will find Learned ISPs, RAW Restoration-U…

$ npx skills add mv-lab/AISP
579 stars38 quality71 trustExperimental1y since pushNeeds review

Scenario GitHub automation

CLI + Codex · 4 targets

jupyter-notebookcomputer-vision
by mv-labDetailsQuick view
10

Reprozip

PROMISING · 59TRUST · 73SAFE · EXPERIMENTALCODING

ReproZip is a tool that simplifies the process of creating reproducible experiments from command-line executions, a frequently-used common denominator in computational s…

$ npx skills add VIDA-NYU/reprozip
362 stars41 quality73 trustExperimental7mo since pushNeeds review

Scenario GitHub automation

CLI + Codex · 4 targets

pythonscientific-computing
by VIDA-NYUDetailsQuick view
11

Spectrochempy

PROMISING · 63TRUST · 75SAFE · REVIEWEDDATA

SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python

$ npx skills add spectrochempy/spectrochempy
176 stars46 quality75 trustReviewed with permission notes2mo since pushNeeds review

Scenario Data analysis

CLI + Codex · 4 targets

pythondata-analysis
by spectrochempyDetailsQuick view
12

Scientific Agent Skills

VERIFIEDEXCELLENT · 100TRUST · 91SAFE · VERIFIEDDATA

Turn any AI agent into an AI Scientist. The #1 Agent Skills library for science, used by 160,000+ scientists worldwide. 140 ready-to-use skills plus 100+ scientific data…

$ npx skills add K-Dense-AI/scientific-agent-skills
33.5K stars75 quality91 trustVerifiedClaude Code + OpenAI Agents8d since pushSafe to try

Scenario Data analysis

Claude Code + OpenAI Agents · 4 targets

pythondata-analysis
by K-Dense-AIDetailsQuick view
13

CompFinance

NEEDS REVIEW · 38TRUST · 67SAFE · EXPERIMENTALFINANCE

Companion code for "Modern Computational Finance: AAD and Parallel Simulations" (Antoine Savine, Wiley, 2018)

$ npx skills add asavine/CompFinance
200 stars35 quality67 trustExperimental5y since pushNeeds review

Scenario Finance and quant

CLI + Codex · 4 targets

c++finance
by asavineDetailsQuick view
14

Numerical Linear Algebra

VERIFIEDSTRONG · 71TRUST · 79SAFE · REVIEWEDDESIGN

Free online textbook of Jupyter notebooks for fast.ai Computational Linear Algebra course

$ npx skills add fastai/numerical-linear-algebra
10.9K stars56 quality79 trustReviewed with permission notes2y since pushNeeds review

Scenario Multimodal media

CLI + Codex · 4 targets

jupyter-notebookmachine-learning
by fastaiDetailsQuick view
15

Jupyter Book

VERIFIEDEXCELLENT · 96TRUST · 88SAFE · REVIEWEDRESEARCH

Create beautiful, publication-quality books and documents from computational content.

$ npx skills add jupyter-book/jupyter-book
4.3K stars64 quality88 trustReviewed2mo since pushSafe to try

Scenario Document processing

CLI + Codex · 4 targets

typescriptmarkdown
by jupyter-bookDetailsQuick view
16

Nextflow

VERIFIEDEXCELLENT · 95TRUST · 85SAFE · REVIEWEDDATA

A DSL for data-driven computational pipelines

$ npx skills add nextflow-io/nextflow
3.4K stars63 quality85 trustReviewed2mo since pushSafe to try

Scenario Browser automation

CLI + Codex · 4 targets

groovybioinformatics
by nextflow-ioDetailsQuick view

Page 1

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