Alternatives and similar repositories for mdlj:

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

• nomad-coe / greenX
  Library for Green’s function based electronic structure theory calculations
  ☆23Updated last month
• rpep / fmmgen
  Automatic code generation of Fast Multipole and Barnes-Hut operators
  ☆19Updated 2 years ago
• pseewald / fortran-einsum-example
  A generic implementation of tensor einsum in Fortran.
  ☆26Updated 4 years ago
• ECP-copa / CabanaMD
  Molecular dynamics proxy application based on Cabana
  ☆20Updated 3 months ago
• digital-chemistry-laboratory / libconeangle
  Library for calculating exact ligand cone angles
  ☆12Updated 2 years ago
• lanl / qmd-progress
  PROGRESS: Parallel, Rapid O(N) and Graph-based Recursive Electronic Structure Solver.
  ☆20Updated last week
• vanderhe / fortnet
  Fortnet is a Behler-Parrinello-Neural-Network implementation, written in modern Fortran.
  ☆31Updated 3 weeks ago
• pygbe / pygbe
  PyGBe: Python, GPUs and Boundary elements for electrostatics
  ☆66Updated last year
• LLNL / mgmol
  MGmol is a scalable O(N) First-Principles Molecular Dynamics code that is capable of performing large-scale electronics structure calcula…
  ☆43Updated this week
• aamaricci / DMFTtools
  A collection of fortran modules and routines to support quantum many-body calculations, with a strong focus on Dynamical Mean-Field Theor…
  ☆15Updated 3 weeks ago
• MRChemSoft / mrcpp
  MultiResolution Computation Program Package
  ☆12Updated this week
• NWChemEx / TAMM
  Tensor Algebra for many-body methods
  ☆14Updated this week
• anjohan / neuralnetwork
  Simple, parallel, object-oriented Fortran neural network
  ☆20Updated 6 years ago
• LLNL / TopoMS
  Topological Analysis for Molecular Systems
  ☆17Updated 5 years ago
• joaander / hoomd-blue
  ☆19Updated 2 years ago
• wavefunction91 / scalapackpp
  C++17 Wrapper for ScaLAPACK
  ☆11Updated last year
• murillo-group / sarkas
  Sarkas Python MD suite for Dense Plasmas Physics
  ☆15Updated 6 months ago
• MRChemSoft / mrchem
  MultiResolution Chemistry
  ☆31Updated this week
• ebylaska / PWDFT
  Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software
  ☆15Updated last week
• LLNL / irep
  A tool for filling C/C++ or Fortran data structures from Lua input tables
  ☆15Updated last year
• setten / GW100
  GW100 data repository and post processing tools
  ☆11Updated last year
• fortran-lang / stdlib-cmake-example
  Integration of the Fortran standard library in CMake projects
  ☆13Updated 3 years ago
• myousefi2016 / Cahn-Hilliard-CUDA
  Cahn Hilliard CUDA (Phase-Field Simulation of Spinodal Decomposition)
  ☆13Updated 5 years ago
• SM-at-THU / StatisticalMechanics
  This is a collection of answers to a SM book written by R. K. Pathria & Paul D. Beale. Lecture notes can be added too.
  ☆35Updated 6 years ago
• ImperialCollegeLondon / RCDS-introduction-to-fortran
  An Introductory Fortran course delivered by the Imperial College London Graduate School.
  ☆15Updated 2 months ago
• LLNL / inq
  This is a mirror. Please check our main website on gitlab.
  ☆27Updated 2 weeks ago
• ben-albrecht / qcl
  Quantum Chemistry Laboratory package
  ☆19Updated 2 years ago
• SourceryTools / fortran-cuda-interfaces
  ☆23Updated 6 months ago
• vmagnin / fundamental_constants
  Fortran modules with the CODATA fundamental physical constants, generated by a Python script.
  ☆14Updated 8 months ago