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M

Maria Cristina Gamberini

university of modena and reggio emilia

26H指数
134论文数
1.9K被引数
收录论文 59
发表时间
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Charge transfer and adsorption mechanisms of a heterocyclic carboxamide on silver nanoclusters: a combined SERS–DFT study杂环羧酰胺在银纳米簇上的电荷转移和吸附机制：一种结合SERS–DFT的研究
errJournal of Molecular Structure
IF4.7
err2026-08-17
err0
PREAI
errJamelah S. Al-Otaibi; Y. Sheena Mary; Martin Juhas; Jan Zitko; Maria Cristina Gamberini
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DFT insights into dopamine adsorption on pristine and Ag-doped carbon nanotubes: implications for SERS sensing applications密度泛函理论对多巴胺在原始和Ag掺杂碳纳米管上吸附的见解：对SERS传感应用的启示
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2026-06-23
err0
PREAI
errJamelah S. Al-Otaibi; Y. Sheena Mary; Y. Bhargav Kumar; Kaippallil S. Resmi; Gaurav Jhaa; Maria Cristina Gamberini
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Concentration-dependent SERS, DFT, NCI, and molecular dynamics investigation of N-(5-chloropyrazin-2-yl)-4-ethylbenzamide (CEB) adsorbed on silver colloid浓度依赖性SERS、DFT、NCI和分子动力学研究N-(5-氯吡嗪-2-基)-4-乙基苯甲酰胺(CEB)吸附在银胶体上
errSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
IF4.6
err2026-05-14
err0
PREAI
errJamelah S. Al-Otaibi; Y. Sheena Mary; Jan Zitko; Christian Van Alsenoy; Maria Cristina Gamberini
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DFT, spectroscopic and MD insights into teneligliptin (TLG) adsorption on Cu3 and Cu(111): Implications for SERS sensing and drug-metal interfacesDFT、光谱学和分子动力学对teneligliptin (TLG)在Cu3和Cu(111)上吸附的见解：对SERS传感和药物-金属界面的启示
errSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
IF4.6
err2026-04-06
err0
PREAI
errJamelah S. Al-Otaib; Y. Sheena Mary; Mirjalol Ismoilov; Gaurav Jhaa; Maria Cristina Gamberini
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DFT-Driven SERS Insight into Epoxycyclohexane (CHO) Adsorption on Ag20, Au20 and Cu20 Nanoclusters for Sensing Applications密度泛函理论驱动的表面增强拉曼光谱对环氧环己烷（CHO）在Ag20、Au20和Cu20纳米簇上吸附的传感应用见解
errJournal of Computational Biophysics and Chemistry
IF2.3
err2026-04-01
err0
PREAI
errAl-Otaibi, Jamelah S.; Alamro, Fowzia S.; Almugrin, Aljawhara H.; Sheena Mary, Y.; Jhaa, Gaurav; Cheerlin Mishma, J. N.; Sivasankaran, Roxy. M.; Gamberini, Maria Cristina
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Density functional theory investigation of hydroxyzine adsorption on silver clusters: implications for SERS-based sensing and interfacial stability密度泛函理论对羟基安定在银团簇上吸附的研究：对基于SERS的传感和界面稳定性的启示
errJournal of Molecular Liquids
IF5.2
err2026-03-18
err0
PREAI
errJamelah S. Al-Otaib; Y. Sheena Mary; Mirjalol Ismoilov; Gaurav Jhaa; Maria Cristina Gamberini
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Adsorption and electronic interactions of glycine on Al12N12 & B12N12 nanocages: A DFT study甘氨酸在Al12N12和B12N12纳米笼上的吸附与电子相互作用：一项DFT研究
errJournal of Molecular Liquids
IF5.2
err2026-02-12
err0
PREAI
errJamelah S. Al-Otaibi; Fowzia S. Alamro; Aljawhara H. Almugrin; Y. Sheena Mary; Asmita Mondal; Nivedita Acharjee; Maria Cristina Gamberini
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C6N8 carbon-nitride monolayer as a sensitive SERS-active sensor and carrier for methimazole: DFT, solvent and docking insightsC6N8碳氮化物单层作为敏感的SERS活性传感器和甲巯咪唑载体：DFT、溶剂和对接研究
errSurface Science
IF1.8
err2026-02-01
err2
PREAI
errAl-Otaibi, Jamelah S.; Mary, Y. Sheena; Jethawa, Unnati; Chakraborty, Brahmananda; Gamberini, Maria Cristina
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SERS spectra, AIM, and MD investigations of a bioactive acetamide, an AChE and BChE inhibitor derivative表面增强拉曼光谱、原子间相互作用势和分子动力学对一种生物活性乙酰胺（AChE和BChE抑制剂衍生物）的研究
errJournal of Nanoparticle Research
IF2.6
err2026-01-09
err1
PREAI
errAl-Otaibi, Jamelah S.; Mary, Y. Sheena; Kratky, Martin; Vinsova, Jarmila; Acharjee, Nivedita; Gamberini, Maria Cristina
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Computational Insights Into Melanin-Cu3/Ni3/Fe3/Zn3 Interactions for Sensing and Biomedical Applications黑色素-Cu3/Ni3/Fe3/Zn3相互作用在传感和生物医学应用中的计算洞察
errChemistrySelect
IF2
err2026-01-09
err1
PREAI
errAl-otaib, Jamelah S.; Mary, Y. Sheena; M.s, Roxy.; Jhaa, Gaurav; Kaya, Savas; Gamberini, Maria Cristina
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Computational and spectroscopic insights into 2-(3-methylureido)acetic acid (MUA) adsorption and sensing on coinage bimetallic nanoclusters计算和光谱学对2-(3-甲基脲基)乙酸(MUA)在贵金属双金属纳米簇上的吸附和传感的见解
errChemical Physics
IF2.4
err2026-01-01
err2
PREAI
errAl-Otaibi, Jamelah S.; Alamro, Fowzia S.; Almugrin, Aljawhara H.; Mary, Y. Sheena; Jhaa, Gaurav; Roxy., M. S.; Gamberini, Maria Cristina
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DFT investigation of glucose adsorption and sensing on C24, Be12O12, and Ca12O12 nanocages (vacuum and aqueous media)DFT研究葡萄糖在C24、Be12O12和Ca12O12纳米笼上的吸附与传感（真空和水介质）
errChemical Papers
IF2.5
err2026-01-01
err0
PREAI
errAl-Otaibi, Jamelah S.; Mary, Y. Sheena; Beegum, Shargina; Bhagyasree, J. B.; Gamberini, Maria Cristina
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Adsorption and sensing of vildagliptin on coinage metal nanoclusters: DFT, MD and spectroscopic insightsvildagliptin在造币金属纳米团簇上的吸附和传感: DFT，MD和光谱见解
errCOMPUTATIONAL AND THEORETICAL CHEMISTRY
IF2.8
err2025-12-01
err0
PREAI
errAl-Otaibi, Jamelah S.; Mary, Y. Sheena; Baiju, Vasudevan; Jalaja, K.; Gamberini, Maria Cristina
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Unlocking the Potential of CDK4/6 Inhibitors: A Deep Dive into Abemaciclib, Palbociclib, and Ribociclib Succinate via DFT, Docking, Pharmacokinetics and MD Simulations解锁CDK4/6抑制剂的潜力：基于DFT、对接、药代动力学和MD模拟对Abemaciclib、Palbociclib和Ribociclib Succinate的深入探究
errPOLYCYCLIC AROMATIC COMPOUNDS
IF2.6
err2025-12-01
err0
PREAI
errMary, Y. Sheena; Baiju, V.; Al-Otaibi, Jamelah S.; Gamberini, Maria Cristina
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Computational insights into quetiapine adsorption on coinage metal nanoclusters: mechanistic basis for sensing and nanomedicine关于奎etiapine在贵金属纳米簇上吸附的计算研究：传感和纳米医学的机制基础
errCHEMICAL PAPERS
IF2.5
err2025-12-01
err1
PREAI
errAl-Otaibi, Jamelah S.; Mary, Y. Sheena; Mishma, J. N. Cheerlin; Gayathri, B.; Resmi, K. S.; Gamberini, Maria Cristina
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SERS, docking and MD simulations of 2-methylene-4-oxo-4-[(3,4,5-tri-chlorophenyl)amino]butanoic acid (MTB): experimental and DFT modelingSERS、对接和MD模拟2-亚甲基-4-氧代-4-[(3,4,5-三氯苯基)氨基]丁酸（MTB）：实验与DFT建模
errSURFACE SCIENCE
IF1.8
err2025-10-01
err0
PREAI
errAl-Otaibi, Jamelah S.; Mary, Y. Sheena; Kratky, Martin; Vinsova, Jarmila; Gamberini, Maria Cristina
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Exploring the interaction of 4-chlorophenyl adamantan-1-yl-carbamate with silver colloid nanoparticles: SERS, DFT, and MD simulations探索4-氯苯基adamantan-1-基-氨基甲酸酯与银胶体纳米粒子的相互作用：SERS、DFT和MD模拟
errJournal of Molecular Liquids
IF5.2
err2025-07-22
err0
PREAI
errJamelah S. Al-Otaibi; Y. Sheena Mary; Martin Krátký; Jarmila Vinsova; Maria Cristina Gamberini
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Examining the adsorption and sensing characteristics of cytosine (CTE) on Y9N9 (Y = Al, B, Ga) nanorings using solvent effects, DFT, AIM and SERS analyses
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2025-06-12
err0
PREAI
errAl-Otaibi, Jamelah S.; Mary, Y. Sheena; Jethawa, Unnati; Chakraborty, Brahmananda; Gamberini, Maria Cristina
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Tracing the path to inclusion: lecturers' perspectives on innovative and inclusive teaching methods
errHUMANITIES & SOCIAL SCIENCES COMMUNICATIONS
IF3.6
err2025-04-02
err0
errOAAI
errNegri, Isabella; Pistoresi, Barbara; Gamberini, Maria Cristina; Mecugni, Daniela
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β-Cyclodextrin nanosponges for the ocular delivery of therapeutic Micro-RNA in a Mouse model of retinitis Pigmentosa: A proof of concept studyβ-环糊精纳米海绵在色素性视网膜炎小鼠模型中用于治疗性微RNA的眼部递送：一项概念验证研究
errEUROPEAN JOURNAL OF PHARMACEUTICS AND BIOPHARMACEUTICS
IF4.3
err2025-03-01
err0
PREAI
errPiano, Ilaria; Polini, Beatrice; Corsi, Francesca; Carpi, Sara; Petrarolo, Giovanni; Quattrini, Luca; D'Agostino, Ilaria; Gamberini, Maria Cristina; Baraldi, Cecilia; Chiellini, Grazia; Nieri, Paola; La Motta, Concettina; Gargini, Claudia
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研究方向

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合作学者
合作期刊
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S
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A
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Y
Y. Sheena Mary
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