Sam-Roggeman/SamRoggeman_Thesis_Dataset_full
收藏Hugging Face2026-04-09 更新2026-03-29 收录
下载链接：
https://hf-mirror.com/datasets/Sam-Roggeman/SamRoggeman_Thesis_Dataset_full
下载链接
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资源简介：
---
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
- split: validation
path: data/validation-*
- split: unseen_trajects
path: data/unseen_trajects-*
dataset_info:
features:
- name: pdb_id
dtype: string
- name: dpp_class
dtype: string
- name: ligand_name
dtype: string
- name: binding_type
dtype: string
- name: coordinates
list:
list: float32
- name: num_atoms
dtype: int16
- name: replica_id
dtype: int8
splits:
- name: train
num_bytes: 436846691006
num_examples: 1008074
- name: test
num_bytes: 93624024181
num_examples: 216042
- name: validation
num_bytes: 93613881805
num_examples: 216028
- name: unseen_trajects
num_bytes: 277372463504
num_examples: 640064
download_size: 718710378722
dataset_size: 901457060496
---
提供机构：
Sam-Roggeman
