Browse applications

Applications

Gadget

153 runs overall, including 0 for the last 60 days. Unique users: 5 Publications: 1

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IceNine

529 runs overall, including 0 for the last 60 days. Unique users: 5 Publications: 3

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R

22 runs overall, including 0 for the last 60 days. Unique users: 2 Publications: 9

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SpEC

2427 runs overall, including 0 for the last 60 days. Unique users: 6

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abinit

1237 runs overall, including 0 for the last 60 days. Unique users: 8 Publications: 1

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acml

3991 runs overall, including 0 for the last 60 days. Unique users: 19 Publications: 36

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amber

25676 runs overall, including 0 for the last 60 days. Unique users: 48 Publications: 22

(AmberTools) AmberTools consists of several independently developed packages that work well by themselves, and with Amber itself. The suite can also be used to carry out complete (non-periodic) molecular dynamics simulations (using NAB), with generalized Born solvent models

arts

1560 runs overall, including 0 for the last 60 days. Unique users: 8

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boost

1354 runs overall, including 0 for the last 60 days. Unique users: 11 Publications: 17

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cactus

13136 runs overall, including 0 for the last 60 days. Unique users: 29 Publications: 18

(Cactus) Cactus is an open source problem solving environment designed for scientists and engineers.

charmm

28735 runs overall, including 0 for the last 60 days. Unique users: 19 Publications: 12

(CHARMM) CHARMM is a molecular simulation program

charmrun

16423 runs overall, including 0 for the last 60 days. Unique users: 61 Publications: 66

(CHARMM) CHARMM is a molecular simulation program

cpmd

878 runs overall, including 0 for the last 60 days. Unique users: 5 Publications: 3

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date

651 runs overall, including 0 for the last 60 days. Unique users: 49 Publications: 9

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ddt

205 runs overall, including 0 for the last 60 days. Unique users: 27 Publications: 2

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desmond

1033 runs overall, including 0 for the last 60 days. Unique users: 8 Publications: 12

Molecular dynamics simulations for biomolecular systems

engine

505 runs overall, including 0 for the last 60 days. Unique users: 8

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enkf

2070 runs overall, including 0 for the last 60 days. Unique users: 8

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env

3379 runs overall, including 0 for the last 60 days. Unique users: 7 Publications: 37

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enzo

1463 runs overall, including 0 for the last 60 days. Unique users: 10 Publications: 11

an adaptive mesh refinement (AMR) code for astrophysical fluid dynamics simulations

fftw3

332940 runs overall, including 0 for the last 60 days. Unique users: 145 Publications: 100

(FFTW) FFTW is a C subroutine library for computing the discrete Fourier transform (DFT)

fftw3_3

8 runs overall, including 0 for the last 60 days. Unique users: 1 Publications: 1

(FFTW) FFTW is a C subroutine library for computing the discrete Fourier transform (DFT)

flash

1217 runs overall, including 0 for the last 60 days. Unique users: 20 Publications: 14

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frontendlauncher

60 runs overall, including 0 for the last 60 days. Unique users: 8 Publications: 1

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gamess

1130 runs overall, including 0 for the last 60 days. Unique users: 12 Publications: 7

(GAMESS) GAMESS is a program for ab initio molecular quantum chemistry

geogrid

646 runs overall, including 0 for the last 60 days. Unique users: 18 Publications: 6

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gmp

115 runs overall, including 0 for the last 60 days. Unique users: 2

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gotoblas2

18 runs overall, including 0 for the last 60 days. Unique users: 2

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gromacs

260628 runs overall, including 0 for the last 60 days. Unique users: 347 Publications: 198

(GROMACS) GROMACS is a molecular dynamics package, which simulates Newtonian equations of motion for systems with hundreds to millions of particles.

gsl

44215 runs overall, including 0 for the last 60 days. Unique users: 45 Publications: 20

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gulp

8244 runs overall, including 0 for the last 60 days. Unique users: 2 Publications: 2

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hdf5

37103 runs overall, including 0 for the last 60 days. Unique users: 33 Publications: 26

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hecura

4 runs overall, including 0 for the last 60 days. Unique users: 2

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hello

37 runs overall, including 0 for the last 60 days. Unique users: 10 Publications: 18

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hostname

15 runs overall, including 0 for the last 60 days. Unique users: 6

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hpcrun

1338 runs overall, including 0 for the last 60 days. Unique users: 29 Publications: 14

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hybrid

76 runs overall, including 0 for the last 60 days. Unique users: 17

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ideal

774 runs overall, including 0 for the last 60 days. Unique users: 9 Publications: 7

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jacobi

273 runs overall, including 0 for the last 60 days. Unique users: 51 Publications: 1

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jdk32

1 runs overall, including 0 for the last 60 days. Unique users: 1

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lammps

191648 runs overall, including 0 for the last 60 days. Unique users: 73 Publications: 32

(LAMMPS) LAMMPS is a classical molecular dynamics code, and an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator.

main

3315 runs overall, including 0 for the last 60 days. Unique users: 18 Publications: 6

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mas

1010 runs overall, including 0 for the last 60 days. Unique users: 5

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master

47 runs overall, including 0 for the last 60 days. Unique users: 17

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meep

35393 runs overall, including 0 for the last 60 days. Unique users: 6

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mesa

192 runs overall, including 0 for the last 60 days. Unique users: 3

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metgrid

4376 runs overall, including 0 for the last 60 days. Unique users: 19 Publications: 11

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mkl

31631 runs overall, including 0 for the last 60 days. Unique users: 122 Publications: 67

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mpi

43990 runs overall, including 0 for the last 60 days. Unique users: 61 Publications: 36

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mpiblast

48 runs overall, including 0 for the last 60 days. Unique users: 2

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mpihello

39 runs overall, including 0 for the last 60 days. Unique users: 13

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mpitest

82 runs overall, including 0 for the last 60 days. Unique users: 12

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mvapich-devel

394 runs overall, including 0 for the last 60 days. Unique users: 5 Publications: 8

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mvapich-old

37369 runs overall, including 0 for the last 60 days. Unique users: 25 Publications: 4

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mvapich2-new

9037 runs overall, including 0 for the last 60 days. Unique users: 3 Publications: 2

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namd

77854 runs overall, including 0 for the last 60 days. Unique users: 83 Publications: 81

(NAMD) NAMD is a simulator for large biomolecular systems, based on CHARM++, VMD, and compatible with CHARMM, AMBER, and X-PLOR

ncl_ncarg

610 runs overall, including 0 for the last 60 days. Unique users: 4

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netcdf

1012 runs overall, including 0 for the last 60 days. Unique users: 7 Publications: 1

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numactl

1657 runs overall, including 0 for the last 60 days. Unique users: 44 Publications: 6

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nwchem

4248 runs overall, including 0 for the last 60 days. Unique users: 20 Publications: 2

(NWCHEM) Scalable computational chemistry tools for supercomputers or workstation clusters

olympus

5411 runs overall, including 0 for the last 60 days. Unique users: 5 Publications: 2

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openggcm

152 runs overall, including 0 for the last 60 days. Unique users: 6

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padcirc

666 runs overall, including 0 for the last 60 days. Unique users: 12

(ADCIRC) ADCIRC solves time dependent, free surface circulation and transport problems in two and three dimensions

padcswan

515 runs overall, including 0 for the last 60 days. Unique users: 9

(ADCIRC) ADCIRC solves time dependent, free surface circulation and transport problems in two and three dimensions

papi

184 runs overall, including 0 for the last 60 days. Unique users: 48 Publications: 5

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paraview

10 runs overall, including 0 for the last 60 days. Unique users: 1

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parsec

531 runs overall, including 0 for the last 60 days. Unique users: 6 Publications: 6

(PARSEC) PARSEC does ab initio quantum-mechanical calculations of the electronic structure of matter, within density-functional theory.

pfd

503 runs overall, including 0 for the last 60 days. Unique users: 6

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pgi

261351 runs overall, including 0 for the last 60 days. Unique users: 340 Publications: 132

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phdf5

320 runs overall, including 0 for the last 60 days. Unique users: 5

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pio

3471 runs overall, including 0 for the last 60 days. Unique users: 10 Publications: 3

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ppi

200 runs overall, including 0 for the last 60 days. Unique users: 7

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projwfc

142 runs overall, including 0 for the last 60 days. Unique users: 7

(Quantum ESPRESSO) Quantum ESPRESSO does nanoscale electronic-structure calculations and materials modeling

python

61502 runs overall, including 0 for the last 60 days. Unique users: 114 Publications: 71

(Python) The python language

qwalk

971 runs overall, including 0 for the last 60 days. Unique users: 6

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real

6021 runs overall, including 0 for the last 60 days. Unique users: 27 Publications: 12

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rocflocm

1116 runs overall, including 0 for the last 60 days. Unique users: 6

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run

10370 runs overall, including 0 for the last 60 days. Unique users: 60 Publications: 48

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rungms

1199 runs overall, including 0 for the last 60 days. Unique users: 7 Publications: 9

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scalasca

3 runs overall, including 0 for the last 60 days. Unique users: 1

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script

170 runs overall, including 0 for the last 60 days. Unique users: 9

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siesta

7314 runs overall, including 0 for the last 60 days. Unique users: 19 Publications: 14

(SIESTA) SIESTA does electronic structure calculations and ab initio molecular dynamics simulations of molecules and solids

silo

18 runs overall, including 0 for the last 60 days. Unique users: 1

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tar

1 runs overall, including 0 for the last 60 days. Unique users: 1

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test

11058 runs overall, including 0 for the last 60 days. Unique users: 91 Publications: 55

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thread

2912 runs overall, including 0 for the last 60 days. Unique users: 16

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tmpi

13 runs overall, including 0 for the last 60 days. Unique users: 5

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ungrib

481 runs overall, including 0 for the last 60 days. Unique users: 10 Publications: 6

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valgrind

126 runs overall, including 0 for the last 60 days. Unique users: 11 Publications: 19

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vasp

106253 runs overall, including 0 for the last 60 days. Unique users: 184 Publications: 44

(VASP) The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale materials modelling

visit

1044 runs overall, including 0 for the last 60 days. Unique users: 20 Publications: 5

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wrf

59921 runs overall, including 0 for the last 60 days. Unique users: 37 Publications: 20

(WRF) The Weather Research and Forecating Model (WRF) is a mesoscale numerical weather prediction system