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@atomistics/caffeine
Atomic positions and numbers of the caffeine molecule.
@atomistics/elements
A table of information about the chemical elements.
@atomistics/gradient-descent
Given a set of atomic positions and a potential energy calculator, provides a function that steps in the direction of the force.
@atomistics/lennard-jones-pairwise-js
Pairwise lennard-jones potential in javascript.
@atomistics/pairwise-potential
Takes a pairwise function and returns a function that can calculate the energy from a set of 3D positions.
@atomistics/xyz
An xyz chemical file format parser and tools for interacting with xyz files.
candygraph
Fast by default, flexible 2D plotting library.
canvas-video-generator
Generate smooth videos from browser canvas elements.
dis-gui
An extensible, styleable, & React-based controller library inspired by the venerable dat-gui.
geo-3d-transform-mat4
Transform geometry positions with a 4x4 transformation matrix.