Turnitin
降AI改写
早检测系统
早降重系统
Turnitin-UK版
万方检测-期刊版
维普编辑部版
Grammarly检测
Paperpass检测
checkpass检测
PaperYY检测
Observations into quantum simulation, spectroscopy, electronic properties, pharmacokinetics and molecular docking analysis of lawsone against breast cancer
In this current investigation, structural and spectroscopic characteristics of the Lawsone (2-
hydroxy-1, 4-napthoquinone) molecule was examined by density functional theory (DFT) …
hydroxy-1, 4-napthoquinone) molecule was examined by density functional theory (DFT) …
Exploring the co‐activity of FDA approved drug gemcitabine and docetaxel for enhanced anti‐breast cancer activity: DFT, docking, molecular dynamics simulation and …
Combining FDA‐approved medications may increase biological activity by simultaneously
targeting many protein mechanisms while being less toxic. Gemcitabine and docetaxel …
targeting many protein mechanisms while being less toxic. Gemcitabine and docetaxel …
Pharmacoinformatics and quantum chemicals‐based analysis of aromatic molecule decanal as a potent drug against breast cancer
This study's primary goal is to perform density functional theory and molecular docking
simulation to determine decanal's structural stability and biological activity against proteins …
simulation to determine decanal's structural stability and biological activity against proteins …
Synthesis of 1-piperoylpiperidine investigated through spectroscopy, quantum computation, pharmaceutical activity, docking and MD simulation against breast cancer
Piperoylpiperidine (1-PIP) was crystallized as a single unit by a slow evaporation process,
and it was examined using XRD and FT-IR spectroscopy. The centrosymmetric monoclinic …
and it was examined using XRD and FT-IR spectroscopy. The centrosymmetric monoclinic …
Investigation on 5-Isopropyl-2-Methylphenol via Quantum Chemicals, pharmacokinetics, molecular docking and cytotoxicity evaluation against breast Cancer
The 5-isopropyl-2-methylphenol (5IP2MP) molecule, a monoterpenoid phenol mostly
existing in the essential oil of Origanum vulgare L., was used as a potent breast cancer …
existing in the essential oil of Origanum vulgare L., was used as a potent breast cancer …
Encapsulating 2-aminopyridine with zeolite imidazole framework nanoparticles for induction of cell death via pH-responsive delivery in hepatocellular carcinoma …
The key objective for establishing a new drug delivery system is to transport therapeutic
medications in the body's circulatory system and deliver them to selected therapeutic spots …
medications in the body's circulatory system and deliver them to selected therapeutic spots …
Combined experimental and quantum computational studies on 5-Fluorouracil salicylic acid cocrystal: Assessment on anti-breast cancer potential through docking …
J Karuppasamy, A Zochedh, BA Al-Asbahi… - Journal of Molecular …, 2024 - Elsevier
fluorouracil salicylic acid (5FUSA) cocrystal was synthesised via mechanochemical and
solution evaporation technique and spectroscopic experiments and theoretical research …
solution evaporation technique and spectroscopic experiments and theoretical research …
Integrating simulated and experimental studies on novel single crystal bis (guanidininium) n-carboxylatephenylalanine towards enhanced antitumor effect
A Zochedh, A Shunmuganarayanan, S Ansar… - Journal of Molecular …, 2025 - Elsevier
A novel organic crystal bis (guanidininium) n-carboxylatephenylalanine (GUPA) was
synthesized and X-ray diffraction outcomes exposed P2 1, triclinic space group with cell …
synthesized and X-ray diffraction outcomes exposed P2 1, triclinic space group with cell …
Exploring the synergistic effect of tegafur-syringic acid adduct against breast cancer through DFT computation, spectroscopy, pharmacokinetics and molecular docking …
The most prevalent kind of cancer and the main reason for cancer-related deaths in women
is breast cancer. Synergistic drug delivery plays an effective role in the treatment of cancer …
is breast cancer. Synergistic drug delivery plays an effective role in the treatment of cancer …
Solid state synthesis of zwitterionic cocrystal 5-fluorouracil L-phenylalanine explicated via structural, spectroscopy, quantum chemicals, Hirshfeld and docking analysis
J Karuppasamy, A Zochedh… - Journal of Molecular …, 2024 - Elsevier
The single crystal 5-Fluorouracil l-phenylalanine (5FUPA) was synthesized using solid state
technique and crystallized at room temperature using the slow evaporation method. The …
technique and crystallized at room temperature using the slow evaporation method. The …