Plug-ins# Plug-ins provide the functionality in SEAMM. Here are links to their documentation, grouped by category: Analysis Atomic Charges Geometry Analysis Building Crystal Builder Dimer Builder Extract Clusters From SMILES Normal Mode Sampling PACKMOL Set Cell Strain Supercell Control Control Parameters Loop Subflowchart Custom Custom Data Properties QCArchive Read Structure System Table Featurizers RDKit Properties Diffusivity Energy Scan Reaction Path Structure Thermal Conductivity Thermochemistry Thermomechanical Simulations DFTB+ Energy FHI-aims Gaussian LAMMPS MBE Model Chemistry MOPAC ORCA Psi4 QuickMin TorchANI VASP xnn xTB Testing Golden Test
