• sPuReMD

  • Referenced in 6 articles [sw12865]
  • describe various data structures, and the charge equilibration solver at the core of the simulation...
  • SuperLU

  • Referenced in 180 articles [sw00930]
  • SuperLU is a general purpose library for the...
  • CPLEX

  • Referenced in 2641 articles [sw04082]
  • IBM® ILOG® CPLEX® offers C, C++, Java, .NET...
  • Gromacs

  • Referenced in 120 articles [sw04128]
  • GROMACS is a versatile package to perform molecular...
  • NewtonLib

  • Referenced in 282 articles [sw04796]
  • Numerical Mathematics - NewtonLib. Software repository for Peter Deuflhards...
  • KELLEY

  • Referenced in 617 articles [sw04829]
  • Iterative methods for optimization This book gives an...
  • LAMMPS

  • Referenced in 60 articles [sw05952]
  • LAMMPS (Large-scale Atomic/Molecular Massively Parallel Simulator) is...
  • CHARMM

  • Referenced in 116 articles [sw05953]
  • CHARMM (Chemistry at HARvard Macromolecular Mechanics). CHARMM models...
  • GAUSSIAN

  • Referenced in 186 articles [sw06118]
  • Gaussian is an electronic structure program, used by...