Material Construction

Porous Materials﻿ mbuild : Component-based system builder
﻿ stk : Construction of framework molecules.
﻿ PORMAKE : Construction of MOFs from pre-defined building blocks
﻿ ToBaCCo : Construction of MOFs from pre-defined building blocks
﻿ PyCOFBuilder : Construction of COFs
﻿ PoreMatMod.jl : Substructure find-and-replace tool for crystal structures
﻿ MOFUN : Find-and-replace in crystal structures
﻿ MAZE : Zeolite classes in ASE
﻿ MOFid : Unique identifiers for MOFs
﻿ moffragmentor : Turn a MOF into its building blocks.
﻿ ZSE : Zeolite structure generation/analysis in ASE
﻿ zeoran : Various kinds of zeolite heteroatom exchange methods
Transition Metal Complexes﻿ Architector : 3D transition metal complex generation
﻿ PyConSolv : 3D transition metal complex generation, with solvent
﻿ molsimplify : 3D transition metal complex generation
﻿ cell2mol : Generate connectivity metadata for molecular crystals
General Purpose﻿ PyXtal : Symmetry-handling tools 
﻿ PACKMOL : For packing molecules in a region of space