Results for “pydantic-v2”
7 skills
lingxling Datamol
Pythonic wrapper around RDKit for cheminformatics, simplifying SMILES parsing, standardization, descriptors, fingerprints, clustering, 3D conformers, and parallel processing while returning native rdkit.Chem.Mol objects.
253 · bundle
k-dense-ai Pymatgen
Analyze and manipulate crystal structures, compute phase diagrams, and access the Materials Project database using the pymatgen library.
30.2k · bundle
k-dense-ai Datamol
Simplify molecular cheminformatics with a Pythonic wrapper around RDKit for SMILES parsing, standardization, descriptors, fingerprints, clustering, 3D conformers, and parallel processing.
30.2k · bundle
k-dense-ai Fluidsim
Run computational fluid dynamics simulations using Python, including Navier-Stokes equations, shallow water, and stratified flows with pseudospectral methods and HPC support.
30.2k · bundle
chen-yu-hao Geopandas
Extends pandas for geospatial vector data operations including reading/writing shapefiles, GeoJSON, and GeoPackage, performing spatial joins, coordinate transformations, and creating static or interactive maps.
5 · bundle
schattenspiegel Pandas Python
Write, review, debug, test, or optimize pandas Series, DataFrame, Index, groupby, merge, reshape, dtype, missing-value, and time-series code.
0 · bundle
k-dense-ai Pyopenms
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.
30.2k · bundle