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160 packages found
Customizable React loading spinner that looks like an atom
Parse a chemical formula to get a count of each element in a compound
A set of chemistry related tools for AngularJS
searchable periodic table of elements
A general purpose module for parsing mgf files
It contains the entire periodic table and has handy functions that return the information of elements and compounds.
A parser for X! tandem xml output files
Get the molar mass of a compound in g/mol
A general purpose module for parsing FASTA files
Given a set of atomic positions and a potential energy calculator, provides a function that steps in the direction of the force.
Takes a pairwise function and returns a function that can calculate the energy from a set of 3D positions.
Pairwise lennard-jones potential in javascript.
NLP for the Optimade queries based on the MPDS data categories
- optimade
- mpds
- pauling file
- chemistry
- chemical formula
- chemical formulae
- periodic table
- materials informatics
Simple Chemical Equation Balancer
- chemistry
- chemicals
- balance
- balancer
- chem
- equilibrium
- elements
- chemical balance
- reaction
- matrix
- chemical reaction
- chemical change
Simple utility library for providing information about the periodic table and the elements.
The package converts smiles to molecular fingerprints based on Morgan's fingerprints.
Add support for mathematical and chemical formulas for you Strapi project!
An xyz chemical file format parser and tools for interacting with xyz files.
Miew - 3D Molecular Viewer
A simple and efficient balancer of chemical equations