Alternatives and similar repositories for molecular-dynamics

Users that are interested in molecular-dynamics are comparing it to the libraries listed below

• RobinKa / tfga
  Python package for Geometric / Clifford Algebra with TensorFlow
  ☆52Updated 2 years ago
• ericjang / pt-jax
  Path Tracing in JAX
  ☆71Updated 5 years ago
• juliusberner / deep_kolmogorov
  Numerically Solving Parametric Families of High-Dimensional Kolmogorov Partial Differential Equations via Deep Learning (NeurIPS 2020)
  ☆22Updated 2 years ago
• imbirik / LieStationaryKernels
  Supplementary code for the paper "Stationary Kernels and Gaussian Processes on Lie Groups and their Homogeneous Spaces"
  ☆43Updated last year
• juniorrojas / springs-integration-pytorch
  Numerical integration methods for mass-springs systems using PyTorch's autodiff
  ☆31Updated 8 months ago
• uncommoncode / morse_smale
  Python tools for Morse Smale Complex analysis and visualization
  ☆10Updated 3 years ago
• vikashg / Geometry-Reading-list
  A curated list of reading material and lecture notes for all things geometry. Mostly focussed on differential and Riemannian geometry wit…
  ☆20Updated 7 years ago
• danielewworrall / cubenet
  3D Roto-translation equivariant convolutions
  ☆54Updated 6 years ago
• justachetan / DiffGeoOps
  Python implementation of the paper "Discrete Differential-Geometry Operators for Triangulated 2-Manifolds" by Meyer et. al. VisMath 2002
  ☆53Updated last year
• ShadowMitia / YACHT
  YACHT 🛳️: Smoothly riding the waves of C++ projects
  ☆11Updated 3 years ago
• katalinic / sdflows
  JAX exponential map normalising flows on sphere
  ☆17Updated 4 years ago
• victoriacity / taichimd
  Interactive, GPU-accelerated Molecular Dynamics using the Taichi programming language
  ☆98Updated 3 years ago
• raymond-yiqunwang / deepKNet
  PointNet-based 3D deep learning model designed for decoding the structure-property relationship for generic crystalline materials.
  ☆10Updated 3 years ago
• zlin7 / CGNet
  ☆70Updated 2 years ago
• cornellius-gp / linear_operator.old
  A LinearOperator implementation for PyTorch
  ☆18Updated 4 years ago
• samihaija / tf-fsvd
  Functional TensorFlow Implementation of Singular Value Decomposition for paper Fast Graph Learning
  ☆13Updated 4 years ago
• google-deepmind / inverse_design
  ☆24Updated last year
• cupy / cupy-benchmark
  CuPy Benchmark
  ☆12Updated 6 years ago
• gcucurull / jax-gcn
  Graph Convolutional Networks in JAX
  ☆32Updated 4 years ago
• mattjj / ode-diff-notes
  ☆12Updated 4 years ago
• AllanSCosta / semantic-protein-folding
  Experiments in protein folding through language modeling
  ☆10Updated 3 years ago
• greydanus / optimize_wing
  We simulate a wind tunnel, place a rectangular occlusion in it, and then use gradient descent to turn the occlusion into a wing.
  ☆26Updated 4 years ago
• glotzerlab / fresnel
  Publication quality path tracing in real time.
  ☆124Updated last week
• smonsays / jax-hypernetwork
  A simple hypernetwork implementation in jax using haiku.
  ☆23Updated 2 years ago
• gbaydin / difftorch
  A differentiation API for PyTorch
  ☆30Updated 5 years ago
• Qualcomm-AI-research / gauge-equivariant-mesh-cnn
  ☆62Updated 2 years ago
• tum-pbs / VOLSIM
  VolSiM, a CNN-based metric to compute the similarity of 3D data from numerical simulations
  ☆15Updated last year
• lucidrains / lie-transformer-pytorch
  Implementation of Lie Transformer, Equivariant Self-Attention, in Pytorch
  ☆93Updated 4 years ago
• lucidrains / geometric-vector-perceptron
  Implementation of Geometric Vector Perceptron, a simple circuit for 3d rotation equivariance for learning over large biomolecules, in Pyt…
  ☆74Updated 4 years ago
• google-deepmind / flows_for_atomic_solids
  ☆51Updated 2 years ago