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Packmol Python Packages

Python packages with the GitHub topic packmol. Sorted by monthly downloads, with stars and forks.
zincware
molify

Create atomistic structures with ASE, rdkit and packmol

18K 29 3
jotelha
jlhpy

Contains input files and workflows underlying J. L. Hörmann, C. (刘宸旭) Liu, Y. (孟永钢) Meng, and L. Pastewka, “Molecular simulations of sliding on SDS surfactant films,” The Journal of Chemical Physics, vol. 158, no. 24, p. 244703, Jun. 2023, doi: 10.1063/5.0153397. as well as an installable Python package jlhpy.

168 1 0
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