File size: 2,086 Bytes
35778e7 0c1a325 35778e7 e85c966 35778e7 0c1a325 35778e7 4f9c3bb 35778e7 4f9c3bb 35778e7 4f9c3bb 35778e7 4f9c3bb 35778e7 4f9c3bb 35778e7 4f9c3bb 35778e7 4f9c3bb 35778e7 2a35bfd 35778e7 59e872c 35778e7 | 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 | ---
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-*
---
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