msb-roshan/BACE
收藏Hugging Face2023-07-03 更新2024-03-04 收录
下载链接:
https://hf-mirror.com/datasets/msb-roshan/BACE
下载链接
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资源简介:
---
dataset_info:
features:
- name: Class
dtype: int64
- name: SMILES
dtype: string
splits:
- name: random_0_train
num_bytes: 92020
num_examples: 1211
- name: random_0_val
num_bytes: 11731
num_examples: 151
- name: random_0_test
num_bytes: 11591
num_examples: 151
- name: random_1_train
num_bytes: 92170
num_examples: 1211
- name: random_1_val
num_bytes: 11363
num_examples: 151
- name: random_1_test
num_bytes: 11809
num_examples: 151
- name: random_2_train
num_bytes: 92139
num_examples: 1211
- name: random_2_val
num_bytes: 11591
num_examples: 151
- name: random_2_test
num_bytes: 11612
num_examples: 151
- name: random_3_train
num_bytes: 92406
num_examples: 1211
- name: random_3_val
num_bytes: 11438
num_examples: 151
- name: random_3_test
num_bytes: 11498
num_examples: 151
- name: random_4_train
num_bytes: 92423
num_examples: 1211
- name: random_4_val
num_bytes: 11374
num_examples: 151
- name: random_4_test
num_bytes: 11545
num_examples: 151
- name: scaffold_0_train
num_bytes: 92069
num_examples: 1210
- name: scaffold_0_val
num_bytes: 11780
num_examples: 151
- name: scaffold_0_test
num_bytes: 11493
num_examples: 152
- name: scaffold_1_train
num_bytes: 93055
num_examples: 1210
- name: scaffold_1_val
num_bytes: 11452
num_examples: 151
- name: scaffold_1_test
num_bytes: 10835
num_examples: 152
- name: scaffold_2_train
num_bytes: 92145
num_examples: 1210
- name: scaffold_2_val
num_bytes: 12240
num_examples: 151
- name: scaffold_2_test
num_bytes: 10957
num_examples: 152
- name: scaffold_3_train
num_bytes: 92634
num_examples: 1210
- name: scaffold_3_val
num_bytes: 11274
num_examples: 151
- name: scaffold_3_test
num_bytes: 11434
num_examples: 152
- name: scaffold_4_train
num_bytes: 92725
num_examples: 1210
- name: scaffold_4_val
num_bytes: 10982
num_examples: 151
- name: scaffold_4_test
num_bytes: 11635
num_examples: 152
download_size: 418827
dataset_size: 1153420
---
# Dataset Card for "BACE"
[More Information needed](https://github.com/huggingface/datasets/blob/main/CONTRIBUTING.md#how-to-contribute-to-the-dataset-cards)
提供机构:
msb-roshan
原始信息汇总
数据集概述
特征信息
- Class:分类标签,数据类型为
int64。 - SMILES:化学结构的字符串表示,数据类型为
string。
数据分割详情
- 随机分割:
- 训练集:共5个,每个包含1211个样本。
- 验证集:共5个,每个包含151个样本。
- 测试集:共5个,每个包含151个样本。
- 基于骨架的分割:
- 训练集:共5个,每个包含1210个样本。
- 验证集:共5个,每个包含151个样本。
- 测试集:共5个,每个包含152个样本。
数据集大小
- 下载大小:418827字节。
- 数据集总大小:1153420字节。



