61 packages matching “cheminformatics”

@rdkit/rdkit

v2025.3.4-1.0.0 · 1 year ago

95
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

JavaScript distribution of cheminformatics functionality from the RDKit - a C++ library for cheminformatics.

53.2KDownloads across all versions in the last 7 days, from the official npm downloads API.BSD-3-ClauseLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v2025.3.4-1.0.0 (the latest release), from the OSV.dev database.

webmolkit

v2.0.8 · 1 year ago

95
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Cheminformatics functionality for JavaScript platforms

848Downloads across all versions in the last 7 days, from the official npm downloads API.Apache 2License declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v2.0.8 (the latest release), from the OSV.dev database.

@datagrok/chem

v1.17.13 · 1 month ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Cheminformatics support: import, rendering, sketching, calculation of properties, predictive models, augmentations, multiple analyses.

404Downloads across all versions in the last 7 days, from the official npm downloads API.

No known vulnerabilities

Known vulnerabilities affecting v1.17.13 (the latest release), from the OSV.dev database.

@haybarn/ext-ducksmiles-h1-5-2

v202605.18.140429 · 2 months ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Cheminformatics toolkit for DuckDB - SMILES, InChI, MOL/SDF, PDB, SELFIES, Wildman-Crippen LogP, and Morgan/ECFP fingerprints from SQL

4Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v202605.18.140429 (the latest release), from the OSV.dev database.

@haybarn/ext-ducksmiles-h1-5-3

v202606.7.123339 · 1 month ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Cheminformatics toolkit for DuckDB - SMILES, InChI, MOL/SDF, PDB, SELFIES, Wildman-Crippen LogP, Morgan/ECFP fingerprints, and Tanimoto similarity from SQL

4Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v202606.7.123339 (the latest release), from the OSV.dev database.

@haybarn/ext-ducksmiles-h1-5-4

v202606.7.123339 · 1 month ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Cheminformatics toolkit for DuckDB - SMILES, InChI, MOL/SDF, PDB, SELFIES, Wildman-Crippen LogP, Morgan/ECFP fingerprints, and Tanimoto similarity from SQL

4Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v202606.7.123339 (the latest release), from the OSV.dev database.

@rdkit/rdkit-temporary-testing

v2022.3.6-beta · 4 years ago

85
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

JavaScript distribution of cheminformatics functionality from the RDKit - a C++ library for cheminformatics.

2Downloads across all versions in the last 7 days, from the official npm downloads API.BSD-3-ClauseLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v2022.3.6-beta (the latest release), from the OSV.dev database.

rdkit-agent

v0.1.1 · 4 months ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Agent-first cheminformatics CLI using Node.js + RDKit WASM

10Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v0.1.1 (the latest release), from the OSV.dev database.

debugdebug

v2022.3.3-debug2 · 4 years ago

85
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

JavaScript distribution of cheminformatics functionality from the RDKit - a C++ library for cheminformatics.

8Downloads across all versions in the last 7 days, from the official npm downloads API.BSD-3-ClauseLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v2022.3.3-debug2 (the latest release), from the OSV.dev database.

@citation/csl-style-journal-of-cheminformatics

v1.0.0 · 2 years ago

90
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

CSL style for Journal of Cheminformatics

2Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v1.0.0 (the latest release), from the OSV.dev database.

tschem

v0.1.0 · 11 years ago

85
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

A TypeScript Cheminformatics library

1Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v0.1.0 (the latest release), from the OSV.dev database.

@datagrok-libraries/utils

v4.7.7 · 23 days ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Common utilities

817Downloads across all versions in the last 7 days, from the official npm downloads API.

No known vulnerabilities

Known vulnerabilities affecting v4.7.7 (the latest release), from the OSV.dev database.

@kent-tokyo/chematic

v0.10.0 · 21 hours ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

WebAssembly bindings for chematic — use chematic from JavaScript/TypeScript

622Downloads across all versions in the last 7 days, from the official npm downloads API.MIT OR Apache-2.0License declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v0.10.0 (the latest release), from the OSV.dev database.

renkin

v0.20.0 · 3 days ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Ultra-fast retrosynthesis engine for computer-aided synthesis planning (CASP) — pure Rust, WASM-ready, Python bindings via PyO3

379Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v0.20.0 (the latest release), from the OSV.dev database.

@squonk/react-sci-components

v2.0.0-dev.14 · 4 years ago

85
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Library of scientific components for use in Squonk Web Apps

54Downloads across all versions in the last 7 days, from the official npm downloads API.Apache-2.0License declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v2.0.0-dev.14 (the latest release), from the OSV.dev database.

@datagrok/tutorials

v1.11.3 · 2 months ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Learn and explore Datagrok through interactive tutorials and a demo app

79Downloads across all versions in the last 7 days, from the official npm downloads API.

No known vulnerabilities

Known vulnerabilities affecting v1.11.3 (the latest release), from the OSV.dev database.

molmass-js

v0.9.4 · 1 month ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Parse chemical formulas and compute molar mass from standard atomic weights.

3Downloads across all versions in the last 7 days, from the official npm downloads API.ISCLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v0.9.4 (the latest release), from the OSV.dev database.

openchem

v0.2.17 · 6 months ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

A fast TypeScript / JavaScript chemistry toolkit for working with molecular structures: parsing & generation (SMILES, MOL, SDF), canonicalization, pattern matching (SMARTS), 2D rendering, and molecular descriptors.

13Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v0.2.17 (the latest release), from the OSV.dev database.

@gonzih/skills-science

v1.1.0 · 4 months ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

Scientific data access skills for Claude Code — arxiv, pubmed, alpha-vantage, nasa, biopython, rdkit, astropy, OpenAlex, FRED, polars, pytorch

24Downloads across all versions in the last 7 days, from the official npm downloads API.MITLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v1.1.0 (the latest release), from the OSV.dev database.

chemcp

v1.1.0 · 5 months ago

100
0-100 score computed by this site from verifiable signals only: known OSV.dev advisories affecting this exact version, how recently it was published, and the repository's OpenSSF Scorecard.

MCP App that renders 2D molecular structures from SMILES using RDKit.js

54Downloads across all versions in the last 7 days, from the official npm downloads API.ISCLicense declared in the package manifest.

No known vulnerabilities

Known vulnerabilities affecting v1.1.0 (the latest release), from the OSV.dev database.
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