metadata
dataset_info:
features:
- name: experiment_id
dtype: string
- name: antibody_name
dtype: string
- name: timestamp
dtype: string
- name: heavy_chain
dtype: string
- name: light_chain
dtype: string
- name: tagg
dtype: float64
- name: tm
dtype: float64
- name: tmon
dtype: float64
- name: job_id
dtype: string
- name: status
dtype: string
- name: duration_seconds
dtype: int64
- name: config_hash
dtype: string
- name: error_message
dtype: string
- name: description
dtype: string
- name: temperatures
dtype: string
- name: simulation_time
dtype: float64
- name: force_field
dtype: string
- name: water_model
dtype: string
- name: salt_concentration
dtype: int64
- name: pH
dtype: float64
- name: p_salt
dtype: string
- name: n_salt
dtype: string
- name: gpu_enabled
dtype: bool
- name: gpu_id
dtype: int64
- name: n_threads
dtype: int64
- name: equilibration_time
dtype: int64
- name: block_length
dtype: string
- name: core_surface_k
dtype: int64
- name: compute_lambda
dtype: bool
- name: use_dummy_s2
dtype: bool
- name: cleanup_temp
dtype: bool
- name: cleanup_after
dtype: string
- name: delete_order_params
dtype: bool
- name: save_trajectories
dtype: bool
- name: gyr_cdrs_Rg_std_350
dtype: float32
- name: bonds_contacts_std_350
dtype: float32
- name: rmsf_cdrl1_std_350
dtype: float32
- name: rmsf_cdrs_mu_400
dtype: float32
- name: gyr_cdrs_Rg_std_400
dtype: float32
- name: all-temp_lamda_b=25_eq=20
dtype: float32
- name: all-temp-sasa_core_mean_k=20_eq=20
dtype: float32
- name: all-temp-sasa_core_std_k=20_eq=20
dtype: float32
- name: r-lamda_b=2.5_eq=20
dtype: float32
- name: git_commit
dtype: string
splits:
- name: train
num_bytes: 8079
num_examples: 14
download_size: 21599
dataset_size: 8079
configs:
- config_name: default
data_files:
- split: train
path: data/train-*