torch_sim.models

Models integrated with TorchSim.

Modules

torch_sim.models.fairchem	Wrapper for FairChem ecosystem models in TorchSim.
torch_sim.models.graphpes	An interface for using arbitrary GraphPESModels in torch_sim.
torch_sim.models.interface	Core interfaces for all models in torchsim.
torch_sim.models.lennard_jones	Classical pairwise interatomic potential model.
torch_sim.models.mace	Wrapper for MACE model in TorchSim.
torch_sim.models.mattersim	TorchSim wrapper for MatterSim models.
torch_sim.models.morse	Anharmonic interatomic potential for molecular dynamics.
torch_sim.models.orb	ORB: PyTorch implementation of ORB models for atomistic simulations.
torch_sim.models.particle_life	Particle life model for computing forces between particles.
torch_sim.models.sevennet	TorchSim wrapper for SevenNet models.
torch_sim.models.soft_sphere	Soft sphere model for computing energies, forces and stresses.