metadata
configs:
- config_name: finetune-fold-0
data_files:
- split: gvrh
path: finetune-fold-0/gvrh-*
- split: kvrh
path: finetune-fold-0/kvrh-*
- split: perov
path: finetune-fold-0/perov-*
- config_name: kvrh-train-filtered
data_files:
- split: fold_0
path: kvrh-train-filtered/fold_0-*
- split: fold_1
path: kvrh-train-filtered/fold_1-*
- split: fold_2
path: kvrh-train-filtered/fold_2-*
- split: fold_3
path: kvrh-train-filtered/fold_3-*
- split: fold_4
path: kvrh-train-filtered/fold_4-*
- config_name: pretrain100k
data_files:
- split: train
path: data/pretrain100k-*
- split: test
path: data/test-*
- config_name: pretrain2m
data_files:
- split: train
path: data/pretrain2m-*
- split: test
path: data/test-*
- config_name: pretrain300k
data_files:
- split: train
path: data/pretrain300k-*
- split: test
path: data/test-*
- config_name: pretrain30k
data_files:
- split: train
path: data/pretrain30k-*
- split: test
path: data/test-*
dataset_info:
- config_name: default
features:
- name: mbid
dtype: string
- name: atom_sequences_plusplus
dtype: string
- name: crystal_text_llm
dtype: string
- name: cif_symmetrized
dtype: string
- name: labels
dtype: float64
- name: atom_sequences
dtype: string
- name: slices
dtype: string
- name: local_env
dtype: string
- name: cif_p1
dtype: string
- name: zmatrix
dtype: string
- name: composition
dtype: string
splits:
- name: finetune_filtered_train
num_bytes: 233974923
num_examples: 87168
download_size: 61699673
dataset_size: 233974923
- config_name: finetune-fold-0
features:
- name: labels
dtype: float64
- name: cif_symmetrized
dtype: string
- name: atom_sequences
dtype: string
- name: local_env
dtype: string
- name: slices
dtype: string
- name: cif_p1
dtype: string
- name: composition
dtype: string
- name: mbid
dtype: string
- name: atom_sequences_plusplus
dtype: string
- name: crystal_text_llm
dtype: string
- name: zmatrix
dtype: string
splits:
- name: gvrh
num_bytes: 13473652
num_examples: 4480
- name: kvrh
num_bytes: 13473652
num_examples: 4480
- name: perov
num_bytes: 21290412
num_examples: 9088
download_size: 12677423
dataset_size: 48237716
- config_name: kvrh-train-filtered
features:
- name: labels
dtype: float64
- name: cif_symmetrized
dtype: string
- name: atom_sequences
dtype: string
- name: local_env
dtype: string
- name: slices
dtype: string
- name: cif_p1
dtype: string
- name: composition
dtype: string
- name: mbid
dtype: string
- name: atom_sequences_plusplus
dtype: string
- name: crystal_text_llm
dtype: string
- name: zmatrix
dtype: string
splits:
- name: fold_0
num_bytes: 13473652
num_examples: 4480
- name: fold_1
num_bytes: 13488529
num_examples: 4480
- name: fold_2
num_bytes: 13899808
num_examples: 4608
- name: fold_3
num_bytes: 9707176
num_examples: 3200
- name: fold_4
num_bytes: 14243601
num_examples: 4736
download_size: 20092703
dataset_size: 64812766