24 packages matching “openchemlib”

nmr-auto-assignment

v0.5.0 · 7 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.

Automatic assignment for Nuclear Magnetic Resonance spectra for small molecules

5Downloads 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 v0.5.0 (the latest release), from the OSV.dev database.

rxn-renderer

v2.0.0 · 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.

RXN file renderer

17Downloads 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 v2.0.0 (the latest release), from the OSV.dev database.

megane-rdkit

v0.1.0 · 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.

RDKit compiled to WebAssembly for megane: ETKDG conformer embedding and MMFF/UFF minimisation today, more RDKit features as megane needs them

0Downloads 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 v0.1.0 (the latest release), from the OSV.dev database.

xtb-wasm

v1.0.0 · 5 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.

GFN2-xTB vibrational spectroscopy in the browser: harmonic frequencies, IR intensities, Raman activities and RRHO thermochemistry, validated against native xtb

0Downloads across all versions in the last 7 days, from the official npm downloads API.GPL-3.0-or-laterLicense declared in the package manifest.

No known vulnerabilities

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