Results for “pymatgen”

Solves single- and multi-objective optimization problems with NSGA-II/III, MOEA/D, and other evolutionary algorithms, including constraint handling, Pareto front analysis, and benchmark problems.

Multi-objective optimization framework. NSGA-II, NSGA-III, MOEA/D, Pareto fronts, constraint handling, benchmarks (ZDT, DTLZ), for engineering design and optimization problems.

Solve single and multi-objective optimization problems using NSGA-II/III, MOEA/D, and other evolutionary algorithms with customizable operators, constraint handling, and benchmark problems.

Analyze proteomics and metabolomics mass spectrometry data with PyOpenMS: read/write MS file formats, process spectra, detect and quantify features, identify peptides and proteins, and run end-to-end LC-MS/MS pipelines using ready-to-run scripts.

Python interface to OpenMS for mass spectrometry data analysis. Use for LC-MS/MS proteomics and metabolomics workflows including file handling (mzML, mzXML, mzTab, FASTA, pepXML, protXML, mzIdentML), signal processing, feature detection, peptide identification, and quantitative analysis. Apply when working with mass spectrometry data, analyzing proteomics experiments, or processing metabolomics datasets.

Multi-objective optimization framework. NSGA-II, NSGA-III, MOEA/D, Pareto fronts, constraint handling, benchmarks (ZDT, DTLZ), for engineering design and optimization problems.

Multi-objective optimization framework. NSGA-II, NSGA-III, MOEA/D, Pareto fronts, constraint handling, benchmarks (ZDT, DTLZ), for engineering design and optimization problems.

Multi-objective optimization framework. NSGA-II, NSGA-III, MOEA/D, Pareto fronts, constraint handling, benchmarks (ZDT, DTLZ), for engineering design and optimization problems.

Multi-objective optimization framework. NSGA-II, NSGA-III, MOEA/D, Pareto fronts, constraint handling, benchmarks (ZDT, DTLZ), for engineering design and optimization problems.

Provides guidance on using the QMT quantitative trading terminal, including strategy development, backtesting, and live trading for Chinese securities markets.

Solve single- and multi-objective optimization problems with NSGA-II/III, MOEA/D, and other evolutionary algorithms, including Pareto front analysis, constraint handling, and benchmarking on standard test problems.

Use for writing, reviewing, debugging, testing, or optimizing Python SymPy symbolic mathematics. Trigger on Symbol, assumptions, Expr, Eq, solve/solveset, simplify, factor, expand, calculus, matrices, exact arithmetic, lambdify, code generation, or symbolic-to-numeric conversion. Do not use for NumPy-only arrays, mpmath-only arbitrary-precision numerics, CVXPY optimization models, or parsing untrusted mathematical text.

Wrapper Pythônico ao redor do RDKit com interface simplificada e padrões sensatos. Preferido para descoberta de fármacos padrão: análise de SMILES, padronização, descritores, fingerprints, clustering, conformadores 3D, processamento paralelo. Retorna objetos nativos rdkit.Chem.Mol. Para controle avançado ou parâmetros customizados, use rdkit diretamente.

Kit de ferramentas de patologia computacional para análise de imagens de lâminas inteiras (WSI) e dados de imagem multiparamétrica. Use esta habilidade ao trabalhar com lâminas de histopatologia, imagens coradas com H&E, imunofluorescência multiplex (CODEX, Vectra), proteômica espacial, detecção/segmentação de núcleos, construção de gráficos de tecido ou treinamento de modelos ML em dados de patologia. Suporta 160+ formatos de lâmina incluindo Aperio SVS, NDPI, DICOM, OME-TIFF para fluxos de trabalho de patologia digital.

Spectral similarity and compound identification for metabolomics. Use for comparing mass spectra, computing similarity scores (cosine, modified cosine), and identifying unknown compounds from spectral libraries. Best for metabolite identification, spectral matching, library searching. For full LC-MS/MS proteomics pipelines use pyopenms.

Build complete mass-spectrometry workflows with pyOpenMS — feature detection, peptide identification, protein quantification, and full LC-MS/MS pipelines across many MS file formats (mzML, mzXML) and algorithms. Use for comprehensive proteomics and MS data processing — for simple spectral comparison and metabolite identification use matchms. Part of the AlterLab Academic Skills suite.

Framework de otimização multi-objetivo. NSGA-II, NSGA-III, MOEA/D, frentes de Pareto, tratamento de restrições, benchmarks (ZDT, DTLZ), para problemas de design e otimização em engenharia.

PyTorch library for audio generation including text-to-music (MusicGen) and text-to-sound (AudioGen). Use when you need to generate music from text descriptions, create sound effects, or perform melody-conditioned music generation.

PyAutoGUI와 OpenCV를 결합하여 화면 고속 캡처, 고정밀 템플릿 매칭, 멀티스레딩 병렬 제어 및 다국어 텍스트 입력 우회를 지원하는 강력한 GUI 자동화 스킬입니다.