semvec/pypi-packages huggingface dataset:
mbuild 0.10.9
mBuild: A hierarchical, component based molecule builder
License: MIT
Keywords: mbuild

mBuild: A hierarchical, component based molecule builder

With just a few lines of mBuild code, you can assemble reusable components into
complex molecular systems for molecular dynamics simulations. mBuild is
designed to minimize or even eliminate the need to explicitly translate and
orient components when building systems: you simply tell it to connect two
pieces! mBuild also keeps track of the system's topology so you don't have to
worry about manually defining bonds when constructing chemically bonded
structures from smaller components.