赵丽娇

2026

多功能壳聚糖纳米载体负载卡莫司汀的作用机制研究

《化学试剂》

2026

叶酸修饰的hBN(Ni)NS靶向递送卡莫司汀的DFT研究

《化学试剂》

DOI

2026

Pristine and metal-doped boron nitride nanosheets as potential nanocarrier drug delivery platform for carmustine: A DFT study

Surfaces and Interfaces

DOI

2026

Atomic-scale insights into the interaction mechanism of carmustine on chitosan nanocarriers: A combined DFT and molecular dynamics study

International Journal of Biological Macromolecules

DOI

2025

氮化硼纳米材料用于药物递送的研究进展

《化学试剂》

DOI

2025

Reduction mechanism of XOR-mediated nitroaromatics hypoxia targeted AGT inhibitors: Molecular docking, MD simulation and ONIOM (QM/MM) investigation

International Journal of Biological Macromolecules

DOI

2025

Natural small molecule thymoquinone increases the chemosensitivity of glioblastoma to temozolomide through inhibiting Wnt/β-catenin signaling pathway to downregulate MGMT expression: In vitro and in vivo validation

Biochemical Pharmacology

DOI

2025

Discovery of a novel Wnt inhibitor DK419: Reversing temozolomide resistance in glioblastoma by switching off Wnt/β-catenin signaling pathway to inhibit MGMT expression

European Journal of Medicinal Chemistry

DOI

2024

Novel strategies to overcome chemoresistance in human glioblastoma

Biochemical Pharmacology

DOI

2024

Lonidamine Increases the Cytotoxic Effect of 1-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-3-(2-chloroethyl)-3-nitrosourea via Energy Inhibition, Disrupting Redox Homeostasis, and Downregulating MGMT Expression in Human Lung Cancer Cell Line

ACS Omega

DOI

2024

Identification of potential natural product derivatives as CK2 inhibitors based on GA-MLR QSAR modeling, synthesis and biological evaluation

Medicinal Chemistry Research

DOI

2024

A Tween-80 modified hypoxia/esterase dual stimulus-activated nanomicelle as a delivery platform for carmustine - Design, synthesis, and biological evaluation

International Journal of Biological Macromolecules

DOI

2024

Energy Blocker Lonidamine Reverses Nimustine Resistance in Human Glioblastoma Cells through Energy Blockade, Redox Homeostasis Disruption, and O 6 -Methylguanine-DNA Methyltransferase Downregulation: In Vitro and In Vivo Validation

ACS Pharmacology & Translational Science

DOI

2024

Mechanism of AGT-Mediated Repair of dG-dC Cross-Links in the Drug Resistance to Chloroethylnitrosoureas: Molecular Docking, MD Simulation, and ONIOM (QM/MM) Investigation

Journal of Chemical Information and Modeling

DOI

2023

介孔硅纳米载体应用于肿瘤治疗的研究进展

《化学试剂》

2023

蛋白激酶CK2天然产物类抑制剂的定量构效关系研究

《北京生物医学工程》

2023

载亚硝基脲的多功能纳米载体的构建及其评价

《化学试剂》

2023

硝基还原酶催化硝基咪唑还原机理的密度泛函理论研究

《化学试剂》

2023

Development and in vitro evaluation of carmustine delivery platform: A hypoxia-sensitive anti-drug resistant nanomicelle with BBB penetrating ability

Biomedicine & Pharmacotherapy

DOI

2023

Integrative proteomics and n-glycoproteomics reveal the synergistic anti-tumor effects of aspirin- and gemcitabine-based chemotherapy on pancreatic cancer cells

Cellular Oncology

DOI

2023

A multi-functional hypoxia/esterase dual stimulus responsive and hyaluronic acid-based nanomicelle for targeting delivery of chloroethylnitrosouea

Journal of Nanobiotechnology

DOI

2023

QSAR and Chemical Read-Across Analysis of 370 Potential MGMT Inactivators to Identify the Structural Features Influencing Inactivation Potency

Pharmaceutics

DOI

2023

Modulating MGMT expression through interfering with cell signaling pathways

Biochemical Pharmacology

DOI

2023

Hypoxia and CD44 receptors dual-targeted nano-micelles with AGT-inhibitory activity for the targeting delivery of carmustine

International Journal of Biological Macromolecules

DOI

2023

The dual role of DNA repair protein MGMT in cancer prevention and treatment

DNA repair

DOI

2022

稠环与非稠环芳烃对大鼠致癌性的定量构效关系研究

《化学试剂》

2022

FMNH介导偶氮苯还原机理的密度泛函理论研究

《化学试剂》

2022

2-Deoxy-D-glucose increases the sensitivity of glioblastoma cells to BCNU through the regulation of glycolysis, ROS and ERS pathways: In vitro and in vivo validation

Biochemical Pharmacology

DOI

2021

壳聚糖-透明质酸支架用于低氧靶向性抗癌药物筛选的研究

《化学试剂》

DOI

2021

QSAR建模及其在抗病毒药物设计与筛选中的研究进展

《化学试剂》

DOI

2021

植物源提取物抑制亚硝胺致癌作用的研究进展

《化学试剂》

DOI

2021

肿瘤靶向性多功能亚硝基脲的合成及抗肿瘤活性评价

《化学试剂》

DOI

2021

Machine Learning Models for the Classification of CK2 Natural Products Inhibitors with Molecular Fingerprint Descriptors

Processes

DOI

2021

Development and biological evaluation of AzoBGNU: A novel hypoxia-activated DNA crosslinking prodrug with AGT-inhibitory activity

Biomedicine & Pharmacotherapy

DOI

2020

基于三维细胞模型的氯乙基亚硝基脲耐药性研究

《化学试剂》

DOI

2020

AGT介导的氯乙基亚硝基脲耐药作用机理的密度泛函理论研究

《化学试剂》

DOI

2020

The Potential of Lonidamine in Combination with Chemotherapy and Physical Therapy in Cancer Treatment

Cancers

DOI

2020

3-Bromopyruvate regulates the status of glycolysis and BCNU sensitivity in human hepatocellular carcinoma cells

Biochemical Pharmacology

DOI

2020

Glycolytic inhibition by 3-bromopyruvate increases the cytotoxic effects of chloroethylnitrosoureas to human glioma cells and the DNA interstrand cross-links formation

Toxicology

DOI

2020

Identification and Biological Evaluation of CK2 Allosteric Fragments through Structure-Based Virtual Screening

Molecules

DOI

2019

Reductive Activity and Mechanism of Hypoxia- Targeted AGT Inhibitors: An Experimental and Theoretical Investigation

International Journal of Molecular Sciences

DOI

2019

Structure-based identification of novel CK2 inhibitors with a linear 2-propenone scaffold as anti-cancer agents

Biochemical and Biophysical Research Communications

DOI

2019

Tumor Energy Metabolism and Potential of 3-Bromopyruvate as an Inhibitor of Aerobic Glycolysis: Implications in Tumor Treatment

Cancers

DOI

2018

NBGNU: a hypoxia-activated Tripartite combi-nitrosourea Prodrug Overcoming AGT-mediated Chemoresistance

Future Medicinal Chemistry

DOI

2018

In Silico Prediction of O6-Methylguanine-DNA Methyltransferase Inhibitory Potency of Base Analogs with QSAR and Machine Learning Methods

Molecules

DOI

2018

Structure‐based Discovery of Novel CK2α‐Binding Cyclic Peptides with Anti‐cancer Activity

Molecular Informatics

DOI

2018

The Specific Role of O 6 -Methylguanine-DNA Methyltransferase Inhibitors in Cancer Chemotherapy

Future Medicinal Chemistry

DOI

2018

Insights into the Impact of Linker Flexibility and Fragment Ionization on the Design of CK2 Allosteric Inhibitors: Comparative Molecular Dynamics Simulation Studies

International Journal of Molecular Sciences

DOI

2017

Exploring the Pivotal Role of the CK2 Hinge Region Sub-Pocket in Binding with Tricyclic Quinolone Analogues by Computational Analysis

Molecules

DOI

2017

The Potential of Combi-Molecules with DNA-Damaging Function as Anticancer Agents

Future Medicinal Chemistry

DOI

2017

Synthesis and Antitumor Activity Evaluation of a Novel Combi-nitrosourea Prodrug: BGCNU

ACS Medicinal Chemistry Letters

DOI

2016

Measurement of O 6 -alkylguanine-DNA alkyltransferase activity in tumour cells using stable isotope dilution HPLC-ESIMS/MS

Journal of Chromatography B

DOI

2016

Identification of the Structural Features of Guanine Derivatives as MGMT Inhibitors Using 3D-QSAR Modeling Combined with Molecular Docking

Molecules

DOI

2016

Synthesis and antitumor activity evaluation of a novel combi-nitrosourea prodrug: Designed to release a DNA cross-linking agent and an inhibitor of O6-alkylguanine-DNA alkyltransferase

Bioorganic & Medicinal Chemistry

DOI

2016

Underlying mechanisms of cyclic peptide inhibitors interrupting the interaction of CK2α/CK2β: comparative molecular dynamics simulation studies

Physical Chemistry Chemical Physics

DOI

2015

Influence of the Expression Level of O6-Alkylguanine-DNA Alkyltransferase on the Formation of DNA Interstrand Crosslinks Induced by Chloroethylnitrosoureas in Cells: A Quantitation Using High-Performance Liquid Chromatography-Mass Spectrometry

PLoS ONE

DOI

2015

The Induction and Repair of DNA Interstrand Crosslinks and Implications in Cancer Chemotherapy

Anti-Cancer Agents in Medicinal Chemistry

DOI

2014

Investigations on the Effect of O6-Benzylguanine on the Formation of dG-dC Interstrand Cross-Links Induced by Chloroethylnitrosoureas in Human Glioma Cells Using Stable Isotope Dilution High-Performance Liquid Chromatography Electrospray Ionization Tandem Mass Spectrometry

Chemical Research in Toxicology

DOI

2014

Comparative investigation of the DNA inter-strand crosslinks induced by ACNU, BCNU, CCNU and FTMS using high-performance liquid chromatography–electrospray ionization tandem mass spectrometry

International Journal of Mass Spectrometry

DOI

2014

Quantification of DNA interstrand crosslinks induced by ACNU in NIH/3T3 and L1210 cells using high‐performance liquid chromatography/electrospray ionization tandem mass spectrometry

Rapid Communications in Mass Spectrometry

DOI

2012

DFT investigations of phosphotriesters hydrolysis in aqueous solution: a model for DNA single strand scission induced by N-nitrosoureas

Journal of Molecular Modeling

DOI

2012

A density functional theory investigation on the formation mechanisms of DNA interstrand crosslinks induced by chloroethylnitrosoureas

International Journal of Quantum Chemistry

DOI

2012

Comparative theoretical investigation of the formation of DNA interstrand crosslinks induced by two kinds of N‐nitroso compounds: nitrosoureas and nitrosamines

Journal of Physical Organic Chemistry

DOI

2011

Quantification of meCCNU ‐induced dG‐dC crosslinks in oligonucleotide duplexes by liquid chromatography/electrospray ionization tandem mass spectrometry

Rapid Communications in Mass Spectrometry

DOI

2011

Relationship between the molecular structure and the anticancer activity of N ‐(2‐chloroethyl)‐ N ′‐cyclohexyl‐ N ‐nitrosoureas: A theoretical investigation

International Journal of Quantum Chemistry

DOI

2010

氯乙基亚硝基脲烷化碱基导致DNA单链断裂的机理研究

《高等学校化学学报》

2010

Quantitative Analysis of DNA Interstrand Crosslink Induced by Chloroethylnitrosoureas with Real-Time Fluorometric Assay

International Conference on Bioinformatics and Biomedical Engineering

DOI

2010

Structural Characterization of the DNA Adducts Induced by 1,3-Bis-(2-Chloroethyl)-1-Nitrosourea Using Electrospray Ionization Tandem Mass Spectrometry

International Conference on Bioinformatics and Biomedical Engineering

DOI

2009

3,5-二甲基-亚硝基哌嗪代谢物对DNA烷化作用的理论研究

《化学学报》

2009

HPLC-ESI-MS/MS Research on DNA Interstrand Cross-Links Formed by 1,3-Bis-(2-Chloroethyl)-1-Nitrosourea

International Conference on Bioinformatics and Biomedical Engineering

DOI

2008

肌氨酰胺亚硝脲药效及药代动力学研究进展

《医学综述》

2008

Agarose Gel Electrophoresis and Fluorometric Assays for the Determination of DNA Cross-Linking Induced by Semustine

International Conference on Bioinformatics and Biomedical Engineering

DOI

2008

A Theoretical Study on the Critical Difference between the Mechanism of DNA Alkylation by Nitrosamines and Nitrosoureas

International Conference on Biomedical Engineering and Informatics (BMEI)

DOI

2008

Study on N-Nitrosoureas by Electron Spray Ionization Mass Spectrometry

International Conference on Bioinformatics and Biomedical Engineering

DOI

2007

Theoretical researches on the molecular structures of DNA crosslinks induced by chloroethylnitrosoureas and QSAR analysis

2007

AN ONIOM STUDY ON THE CROSSLINKED BASE PAIRS IN DNA REACTED WITH CHLOROETHYLNITROSOUREAS

Journal of Theoretical and Computational Chemistry

DOI

2007

The mechanism of DNA alkylation by the β-electrophilic center of nitrosamines and nitrosoureas: a theoretical study

IEEE/ICME International Conference on Complex Medical Engineering

DOI

2007

ONIOM Study on the DNA Interstrand Crosslinks by the Chloroethylnitrosoureas

IEEE/ICME International Conference on Complex Medical Engineering

DOI

2007

Quantitative Structure-Activity Relationship Analysis of the Anticancer Activity of Chloroethylnitrosourea Derivatives

International Conference on Bioinformatics and Biomedical Engineering

DOI

2006

β-甲基亚硝基哌嗪致癌剂第二亲电中心邻基参与作用的理论研究

《高等学校化学学报》

2005

烷基亚硝胺非α-位代谢产物反应活性从头算研究

《物理化学学报》

2019

用于递送亚硝基脲的低氧响应型纳米载体的构建及抗肿瘤活性研究

《第十一届全国化学生物学学术会议论文摘要（第三卷）》

DOI

2005

溶剂对亚硝胺β-代谢物邻基参与作用影响的从头算研究

《中国化学会第四届有机化学学术会议论文集（上册）》