Make module information a dict with name, version, and full_module_name

[ocaisa]

Also reverse the order on toolchain_family (so that it is like 2023a_foss rather than foss_2023a) to help ordering.

Also include minimal extension information directly alongside software.

Fix some bugs as well.

[ocaisa]

We should break here once we have a hit since we want the most recent version.

[ocaisa]

Nasty little bug

[ocaisa]

The new structure now looks like

{
    "GROMACS": {
      "versions": [
        {
          "homepage": "https://www.gromacs.org",
          "license": [],
          "image": "",
          "categories": [],
          "identifier": "",
          "toolchain": {
            "name": "foss",
            "version": "2023b"
          },
          "toolchain_families_compatibility": [
            "2023b_foss"
          ],
          "module": {
            "full_module_name": "GROMACS/2024.4-foss-2023b",
            "module_name": "GROMACS",
            "module_version": "2024.4-foss-2023b"
          },
          "required_modules": [
            {
              "full_module_name": "EESSI/2023.06",
              "module_name": "EESSI",
              "module_version": "2023.06"
            },
            {
              "full_module_name": "GCCcore/13.2.0",
              "module_name": "GCCcore",
              "module_version": "13.2.0"
            },
            {
              "full_module_name": "GROMACS/2024.4-foss-2023b",
              "module_name": "GROMACS",
              "module_version": "2024.4-foss-2023b"
            }
          ],
          "cpu_arch": [
            "aarch64/generic",
            "aarch64/a64fx",
            "x86_64/intel/cascadelake"
          ],
          "gpu_arch": {

          },
          "description": "\nGROMACS is a versatile package to perform molecular dynamics, i.e. simulate the\nNewtonian equations of motion for systems with hundreds to millions of\nparticles.\n\nThis is a CPU only build, containing both MPI and threadMPI binaries\nfor both single and double precision.\n\nIt also contains the gmxapi extension for the single precision MPI build.\n",
          "version": "2024.4",
          "versionsuffix": "",
          "extensions": [
            {
              "type": "python",
              "name": "gmxapi",
              "version": "0.4.2"
            }
          ]
        }
      ],
      "homepage": "https://www.gromacs.org",
      "license": [],
      "image": "",
      "categories": [],
      "identifier": "",
      "description": "\nGROMACS is a versatile package to perform molecular dynamics, i.e. simulate the\nNewtonian equations of motion for systems with hundreds to millions of\nparticles.\n\nThis is a CPU only build, containing both MPI and threadMPI binaries\nfor both single and double precision.\n\nIt also contains the gmxapi extension for the single precision MPI build.\n"
    }
}