Alternatives and similar repositories for Mat2Spec:

Users that are interested in Mat2Spec are comparing it to the libraries listed below

• sparks-baird / matbench-genmetrics
  Generative materials benchmarking metrics, inspired by guacamol and CDVAE.
  ☆36Updated 10 months ago
• kaist-amsg / Composition-Conditioned-Crystal-GAN
  Composition-Conditioned Crystal GAN pytorch code
  ☆43Updated 3 years ago
• OUnke / SpookyNet
  Reference implementation of "SpookyNet: Learning force fields with electronic degrees of freedom and nonlocal effects"
  ☆72Updated 2 years ago
• CompRhys / aviary
  The Wren sits on its Roost in the Aviary.
  ☆53Updated this week
• zhantaochen / phonondos_e3nn
  Code Repository for "Direct prediction of phonon density of states with Euclidean neural network"
  ☆27Updated 2 years ago
• kaist-amsg / imatgen
  image-based generative model for inverse design of solid state materials
  ☆39Updated 3 years ago
• Tinystormjojo / geo-CGNN
  ☆33Updated 9 months ago
• peterbjorgensen / DeepDFT
  Official implementation of DeepDFT model
  ☆75Updated 2 years ago
• asmanouira / CrystalGAN
  Learning to Discover Crystallographic Structures with Generative Adversarial Networks
  ☆38Updated 5 years ago
• PV-Lab / FTCP
  FTCP code
  ☆33Updated last year
• RaymondZhurm / WyCryst
  Wyckoff Inorganic Crystal Generator Framework
  ☆21Updated last month
• zhenpengyao / Supramolecular_VAE
  ☆32Updated 4 years ago
• pfnet-research / charge_transfer_nnp
  Graph neural network potential with charge transfer
  ☆35Updated 3 years ago
• txie-93 / gdynet
  Unsupervised learning of atomic scale dynamics from molecular dynamics.
  ☆81Updated 3 years ago
• JoshRackers / equivariant_electron_density
  Generate and predict molecular electron densities with Euclidean Neural Networks
  ☆47Updated last year
• CompRhys / roost
  Representation Learning from Stoichiometry
  ☆59Updated 2 years ago
• Minoru938 / CSPML
  Original implementation of CSPML
  ☆24Updated 3 months ago
• ilyes319 / mace-tutorials
  Collection of tutorials to use the MACE machine learning force field.
  ☆44Updated 7 months ago
• kyonofx / scdp
  [NeurIPS 2024] source code for "A Recipe for Charge Density Prediction"
  ☆30Updated 4 months ago
• lrcfmd / ChemDASH
  Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments
  ☆22Updated last year
• TUM-DAML / gemnet_tf
  GemNet model in TensorFlow, as proposed in "GemNet: Universal Directional Graph Neural Networks for Molecules" (NeurIPS 2021)
  ☆25Updated last year
• MilesZhao / CubicGAN
  This is the source code of CubicGAN generating cubic crystal structures using improved WGAN.
  ☆10Updated 2 years ago
• MilesZhao / PGCGM
  Source code for generating materials with 20 space groups using PGCGM
  ☆32Updated 2 years ago
• michaeldalverson / CrysTens
  ☆24Updated 7 months ago
• matbench-submission-coGN / CrystalGNNs
  ☆10Updated last year
• txie-93 / polymernet
  ☆22Updated 2 years ago
• kaist-amsg / Synthesizability-PU-CGCNN
  ☆26Updated 3 years ago
• vxfung / MatDeepLearn_DOS
  MatDeepLearn for DOS prediction
  ☆24Updated 2 years ago
• hyllios / CGAT
  Crystal graph attention neural networks for materials prediction
  ☆27Updated last year
• ulissigroup / finetuna
  Active Learning for Machine Learning Potentials
  ☆54Updated 11 months ago