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IMPROVE Patient Data Files

NIAID Data Ecosystem2026-05-01 收录

药物发现

患者数据基准测试

数据链接：

https://figshare.com/articles/dataset/IMPROVE_Patient_Data_Files/23567451 数据链接链接失效反馈

官方服务：

资源简介：

These data is generated for training and benchmarking by the CANDLE framework at https://github.com/pnnl-compbio/candleDataProcessing.

应用场景：

创建时间：

2023-09-22

药物发现

机器学习

HIV-integrase is an important drug target because it catalyzes chromosomal integration of proviral DNA towards establishing latent infection. Computer-aided drug design has immensely contributed to id

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Mechanistic QSAR modeling derived virtual screening, drug repurposing, ADMET and in - vitro evaluation to identify anticancer lead as lysine-specific demethylase 5a inhibitor

药物发现

抗癌研究

A lysine-specific demethylase is an enzyme that selectively eliminates methyl groups from lysine residues. KDM5A, also known as JARID1A or RBP2, belongs to the KDM5 Jumonji histone demethylase subfami

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Validation screen drug combination data

组合药物

药物发现

Raw data supporting Jaaks and Coker et al., 2022 (DOI: 10.1038/s41586-022-04437-2). Drug combination data for all tissues, from validation screen. Users have a non-exclusive, non-transferable right

DataCite Commons2025-06-01 更新60

Schrodinger Phase databases for Enamine REAL lead-like library of 1.56 billion compounds (March 2021)

药物发现

化学信息学

This dataset contains a total of 781 Phase databases in 20 subfolders, created from Enamine REAL lead-like library downloaded in March 2021 (1.56 billion compounds). The compound order in the library

DataCite Commons2023-02-08 更新120

BELKA_frag_6

药物发现

生物信息学

Leash Bio - Predict New Medicines with BELKA

kaggle2024-04-17 更新70