deepmodeling/deepmd-kit · AI Repo StatsDEdeepmodeling/deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
Huấn luyện & fine-tunePython LGPL-3.0 663tạo 2017-12-12 #ase#c#computational-chemistry#cpp#cuda#deep-learning#deepmd#ipi#jax#lammps#machine-learning-potential#materials-science#molecular-dynamics#nodejs#paddle#potential-energy#python#pytorch#rocm#tensorflow