form.yml

cluster:
  - "cardinal"
form:
  - schrodinger_version
  - auto_accounts
  - bc_num_hours
  - bc_num_slots
  - num_cores
  - node_type
  - licenses
  - bc_vnc_resolution
  - bc_email_on_started
attributes:
  schrodinger_version:
    widget: 'select'
    options:
      - ["2023.2", "schrodinger/2023.2"]
      - ["2024.3", "schrodinger/2024.3"]
  num_cores:
    widget: "number_field"
    label: "Number of cores"
    value: 1
    help: |
      Number of cores on node type (4 GB per core unless requesting whole
      node). Leave blank if requesting full node.
    min: 0
    max: 96
    step: 1
  bc_vnc_resolution:
    required: true
  node_type:
    widget: select
    label: "Node type"
    help: |
      - **any** - (*96 cores*) Use any available Cardinal node. This reduces the
        wait time as there are no node requirements.
      - **vis** - (*96 cores*) Use an Cardinal node that has an [NVIDIA H100
        GPU](https://www.nvidia.com/en-us/data-center/h100/) with an X server
        running in the background. This utilizes the GPU for hardware
        accelerated 3D visualization. There are 32 of these nodes on Owens.
      - **hugemem** - (*96 cores*) Use an Cardinal node that has 2 TB of
        available RAM as well as 96 cores. There are 16 of these nodes on
        Owens. Requesting these nodes always reserve entire nodes.
    options:
      - [
          'any', 'any',
          data-max-num-cores: 96,
          data-min-num-cores: 1,
        ]
      - [
          'vis', 'vis',
          data-max-num-cores: 96,
          data-min-num-cores: 1,
        ]
      - [
          'hugemem', 'hugemem',
          data-max-num-cores: 96,
          data-min-num-cores: 43,
        ]
  licenses:
    help: |
      If you want to use use macromodel, glide, ligprep, qikprep, or epik feature in Schrodinger,
      you need to specify it. Licenses are comma separeated in the format '<name>@osc:<# of licenses>'
      like 'glide@osc:1'. More help can be found on our website regarding the changes in the [slurm migration].

      [slurm migration]: https://www.osc.edu/resources/technical_support/supercomputers/owens/environment_changes_in_slurm_migration