torch_sim.neighbors.alchemiopsΒΆ
Alchemiops-based neighbor list implementations.
This module provides neighbor lists via nvalchemiops: prefer the PyTorch subtree
(nvalchemiops.torch.neighbors), typical for CUDA builds, and fall back to
nvalchemiops.neighborlist when that import path is missing (CPU-oriented API
with the same call surface). Supports naive N^2 and cell-list algorithms.
nvalchemiops is available at: https://github.com/NVIDIA/nvalchemiops
Functions
Compute neighbor lists using Alchemiops cell list algorithm. |
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Compute neighbor lists using Alchemiops naive N^2 algorithm. |
Classes
bool(x) -> bool |