Ai-Ping Lu
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Explore the profile of Ai-Ping Lu including associated specialties, affiliations and a list of published articles.
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171
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2078
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Recent Articles
1.
Liu Q, Fan Q, Chen J, Liu J, Li Y, Luo Q, et al.
Adv Sci (Weinh)
. 2025 Jan;
12(10):e2413174.
PMID: 39813169
Triple-negative breast cancer (TNBC) is a subtype of breast cancer with a poor prognosis. The natural compound pristimerin has shown promising anti-tumor effect. Here, it is found that pristimerin significantly...
2.
Zhang X, Wu C, Yi J, Zeng X, Yang C, Lu A, et al.
Research (Wash D C)
. 2024 Sep;
2022:0004.
PMID: 39285949
Accurate prediction of pharmacological properties of small molecules is becoming increasingly important in drug discovery. Traditional feature-engineering approaches heavily rely on handcrafted descriptors and/or fingerprints, which need extensive human expert...
3.
Jiang F, Yue S, Tan Y, Tang N, Xu Y, Zhang B, et al.
Nutrients
. 2024 Jun;
16(11).
PMID: 38892715
NASH (non-alcoholic steatohepatitis) is a severe liver disease characterized by hepatic chronic inflammation that can be associated with the gut microbiota. In this study, we explored the therapeutic effect of...
4.
Yi J, Yang Z, Zhao W, Yang Z, Zhang X, Wu C, et al.
Brief Bioinform
. 2024 Feb;
25(2).
PMID: 38385872
Drug discovery and development constitute a laborious and costly undertaking. The success of a drug hinges not only good efficacy but also acceptable absorption, distribution, metabolism, elimination, and toxicity (ADMET)...
5.
Zhu T, Qian R, Wei X, Lu A, Cao D
J Med Chem
. 2024 Jan;
67(2):1347-1359.
PMID: 38181431
Patents play a crucial role in drug research and development, providing early access to unpublished data and offering unique insights. Identifying key compounds in patents is essential to finding novel...
6.
Yang S, Zhang L, Ge Y, Zhang J, Hu J, Shen C, et al.
J Cheminform
. 2023 Apr;
15(1):48.
PMID: 37088813
Identification and validation of bioactive small-molecule targets is a significant challenge in drug discovery. In recent years, various in-silico approaches have been proposed to expedite time- and resource-consuming experiments for...
7.
Duan Y, Fu L, Zhang X, Long T, He Y, Liu Z, et al.
J Chem Inf Model
. 2023 Mar;
63(8):2345-2359.
PMID: 37000044
The -octanol/buffer solution distribution coefficient at pH = 7.4 (log ) is an indicator of lipophilicity, and it influences a wide variety of absorption, distribution, metabolism, excretion, and toxicity (ADMET)...
8.
Wang L, Shi S, Li H, Zeng X, Liu S, Liu Z, et al.
Brief Bioinform
. 2023 Jan;
24(1).
PMID: 36642412
Machine learning-based scoring functions (MLSFs) have become a very favorable alternative to classical scoring functions because of their potential superior screening performance. However, the information of negative data used to...
9.
Zhang L, Dong J, Wei H, Shi S, Lu A, Deng G, et al.
J Cheminform
. 2022 Dec;
14(1):89.
PMID: 36587232
Traditional Chinese Medicine (TCM) has been widely used in the treatment of various diseases for millennia. In the modernization process of TCM, TCM ingredient databases are playing more and more...
10.
Long T, Shi S, Liu S, Lu A, Liu Z, Li M, et al.
J Chem Inf Model
. 2022 Dec;
63(1):111-125.
PMID: 36472475
Hematotoxicity has been becoming a serious but overlooked toxicity in drug discovery. However, only a few models have been reported for the prediction of hematotoxicity. In this study, we constructed...