Tips & Techniques
The tables below contain links to using and optimizing PGI® compilers and tools with many common scientific and engineering applications, libraries, and benchmarks. Contact PGI support to suggest additions to this list.
| AMBER | ATLAS | CHARMM | GAMESS | LAM/MPI | MCNP5 | MM5 |
| Molpro | MPICH/MPICH2 | NetCDF | OPENGL | Open MPI | POP | WRF |
| Application Version | System | PGI Tool | PGI Versions |
| AMBER Molecular Dynamics Package | |||
|---|---|---|---|
| Version 8 | 32-bit/64-bit Linux | pgf90 | 5.2, 6.0 or later |
| ATLAS - Automatically Tuned Linear Algebra Software | |||
| 3.6.0 | 32-bit/64-bit Linux | pgf90/pgcc | 5.2 |
| 3.7.8 | 32-bit/64-bit Linux | pgf90/pgcc | 6.0 |
| CHARMM - Chemistry at Harvard Macromolecular Mechanics | |||
| v30b2 | 32-bit Linux | pgf90/pgcc | 5.2, 6.0, 7.0, 7.1 |
| v30b2 | 64-bit Linux | pgf90/pgcc | 5.2, 6.0, 7.0, 7.1 |
| v32b1 | 32-bit Linux | pgf90/pgcc | 7.1 |
| v32b1 | 64-bit Linux | pgf90/pgcc | 7.1 |
| GAMESS - The General Atomic and Molecular Electronic Structure System | |||
| December 12, 2003 | 32-bit Linux | pgf77/pgf90/pgcc | 5.x |
| May 14, 2004 | 32-bit Linux | pgf77/pgf90/pgcc | 5.2 |
| November 22, 2004 | 32-bit Linux | pgf77/pgf90/pgcc | 6.0 |
| December 12, 2003 | 64-bit Linux | pgf77/pgf90/pgcc | 5.x |
| May 14, 2004 | 64-bit Linux | pgf77/pgf90/pgcc | 5.2 |
| November 22, 2004 | 64-bit Linux | pgf77/pgf90/pgcc | 6.0 |
| LAM/MPI - Local Area MultiComputer Message Passing Interface (MPI 1 only) | |||
|
7.1.4
|
32-bit/64-bit Linux | pgf90/pgcc/pgf77pgf90 | 7.1 |
| MCNP5 - Monte Carlo N-Particle Transport Code System | |||
|
1.20
|
32-bit/64-bit Linux | pgf90/pgcc | 5.2 |
|
1.30
|
32-bit/64-bit Linux | pgf90/pgcc | 6.0, 6.1, 6.2 |
|
1.40
|
32-bit/64-bit Linux | pgf90/pgcc | 6.1, 6.2,7.0, 7.1 |
| MM5 - PSU/NCAR mesoscale model | |||
| 3.6 | 32-bit Linux | pgf90 | 5.x |
| 3.7 | 32-bit Linux | pgf90 | 6.0 or later |
| 3.6 | 64-bit Linux | pgf90 | 5.x |
| 3.7 | 64-bit Linux | pgf90 | 6.0 or later |
| Molpro Quantum Chemistry Package | |||
| 2002.6 | 32-bit Linux | pgf90/pgcc | 5.2, 6.0, 6.1, 7.1 |
| 2002.6 | 64-bit Linux | pgf90/pgcc | 5.2, 6.0, 6.1 |
| 2002.6 Using MPI | 32-bit Linux | pgf90/pgcc | 6.1 |
| 2002.6 Using MPI | 64-bit Linux | pgf90/pgcc | 6.1 |
| 2006.1 | 32-bit Linux | pgf90/pgcc | 7.1 |
| 2006.1 | 64-bit Linux | pgf90/pgcc | 7.1 |
| 2006.1 Using MPI | 32-bit Linux | pgf90/pgcc | 7.1 |
| 2006.1 Using MPI | 64-bit Linux | pgf90/pgcc | 7.1 |
| MPICH/MPICH2 | |||
| MPICH 1.2.7p1 | 32-bit/64-bit Linux | pgf90/pgcc/pgCC | 7.1 |
| MPICH 1.2.6/1.2.7 | 32-bit/64-bit Linux | pgf90/pgcc/pgCC | 6.0, 6.1,6.2 |
| MPICH2 1.0.4 | 32-bit/64-bit Linux | pgf90/pgcc/pgCC | 6.2 ,7.1 |
| MPICH2 1.1 | 32-bit/64-bit Linux | pgf90/pgcc/pgCC | 8.0 ,9.0 |
| NetCDF - The Network Common Data Form array-oriented data access libraries | |||
|
3.5.1
|
32-bit Linux | pgf90/pgcc | 5.x |
| 3.5.1 | 64-bit Linux | pgf90/pgcc | 5.x |
| 3.6.0-p1 | 32-bit/64-bit Linux | pgf90/pgcc | 6.0, 6.1, 6.2 |
| 3.6.2 | 32-bit/64-bit Linux | pgf90/pgcc | 7.1, 8.0 |
| 3.6.2 | 32-bit/64-bit Linux | pgfortran/pgcc | 9.0 |
| 4.0 | 32-bit/64-bit Linux | pgf90/pgcc | 8.0 |
| 4.0 | 32-bit/64-bit Linux | pgfortran/pgcc | 9.0 |
| OPENGL - The OpenGL F90 graphics libraries | |||
| 1.2.7 | 32-bit/64-bit Linux | pgf90 | 5.0 |
| 1.2.9 | 32-bit/64-bit Linux | pgf90 | 6.0 |
| Open MPI - The Open Source High Performance Message Passing Interface (MPI-2 only) | |||
| 1.2.5 | 32-bit/64-bit Linux | pgcc/pgCC/pgf77/pgf90 | 7.1 |
| 1.3.2 | 32-bit/64-bit Linux | pgcc/pgCC/pgf77/pgf90 | 8.0 |
| 1.3.2 | 32-bit/64-bit Linux | pgcc/pgCC/pgfortran | 9.0 |
| POP - Parallel Ocean Program | |||
|
2.0.1
|
32-bit/64-bit Linux | pgf90/pgcc |
5.2 or later
|
| WRF - Weather Research and Forecasting Model | |||
|
Version 2.0.2
|
64-bit and 32-bit Linux | pgf90/pgcc | 5.2-2 |
|
Version 2.1
|
64-bit and 32-bit Linux | pgf90/pgcc | 6.1 |
|
Version 2.1
|
64-bit and 32-bit Linux | pgf90/pgcc | 7.1 |
|
Version 3.0.1.1
|
64-bit and 32-bit Linux | pgf90/pgcc | 8.0 |