| 1. Python |
3.6.8 (default), 3.8.13, 3.9.13, 2.7.18 |
| 2. Tensorflow |
2.6.2 |
| 3. Anaconda |
3-2022.05 |
| 4. Keras |
2.6.0 |
| 5. Pytorch |
1.10.2+cu113 |
| 6. openCV |
3.4.6 |
| 7. R program |
4.2.2 |
| 8. Transformers |
4.18.0 |
| 9. AMPL |
20221023 |
| 10. C language |
9.4.0 , 8.5.0 |
| 11. Clara Train SDK |
4.1 |
| 12. CUDA Toolkit |
11.1, 11.8, 12.0 |
| 13. CuDNN |
8.7 |
| 14. GCC |
9.4.0 , 8.5.0 |
| 15. GNU C++ |
9.4.0 , 8.5.0 |
| 16. Matplotlib |
3.0.3 |
| 17. NumPy |
1.19.5 , 1.14.3 |
| 18. Open MPI |
4.1.1 (gcc) , 4.1.4 (intel) |
| 19. pandas |
0.25.3 |
| 20. PGI Compiler (NVHPC-2022) |
22.11 |
| 21. Ray |
2.1.0 |
| 22. Julia |
1.8.3 |
| 23. Mkl (bundle with Intel One API) |
2022.2.1 |
| 24. Jupyter notebook |
1.13.5 |
| 25. Gurobi |
10.0 |
| 26. GROMACS |
2022.4 |
| 27. BLAST |
2.13.0 |
| 28. LAMMPS |
20210527 |
| 29. LINGO |
19 |
| 30. Quantum Espresso |
6.8 |
| 31. Singularity |
3.7.1-5.1.ohpc.2.1 |
| 32. ABINIT |
9.6.2 |
| 33. CP2K |
9.1.0 |
| 34. DL_POLY |
4 |
| 35. FreeSurfer |
7.3.2 |
| 36. NAMD |
2.14 |
| 37. NWChem |
7.0.2 |
| 38. OpenFOAM |
10 |
| 39. ORCA |
5.0.3 |
| 40. SIESTA |
4.1.5 |
| 41. WRF |
4.4.1 |
| 42. WRF-Chem |
4.4.1 |