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1Academic Journal
Συγγραφείς: Zhang X; School of Pharmaceutical Sciences, Fudan University, Shanghai 201203, China., Sun Y; School of Pharmaceutical Sciences, Fudan University, Shanghai 201203, China., Wu W; School of Pharmaceutical Sciences, Fudan University, Shanghai 201203, China., Zhang M; School of Pharmaceutical Sciences, Fudan University, Shanghai 201203, China., Lin HW; Department of Pharmacy, Renji Hospital, Shanghai Jiao Tong University School of Medicine, Shanghai 200127, China., Xu J; Department of Pharmacy, Renji Hospital, Shanghai Jiao Tong University School of Medicine, Shanghai 200127, China., Zhou Q; Department of Chemistry and Biochemistry, University of California, Los Angeles, California 90095, United States., Houk KN; Department of Chemistry and Biochemistry, University of California, Los Angeles, California 90095, United States., Zou Y; School of Pharmaceutical Sciences, Shanghai Jiao Tong University, Shanghai 200240, China.; Zhangjiang Institute for Advanced Study, Shanghai Jiao Tong University, Shanghai 201203, China., Yang F; Department of Pharmacy, Renji Hospital, Shanghai Jiao Tong University School of Medicine, Shanghai 200127, China., Sun Y; School of Pharmaceutical Sciences, Fudan University, Shanghai 201203, China.
Πηγή: Journal of the American Chemical Society [J Am Chem Soc] 2025 Dec 10; Vol. 147 (49), pp. 45691-45700. Date of Electronic Publication: 2025 Nov 28.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: American Chemical Society Country of Publication: United States NLM ID: 7503056 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1520-5126 (Electronic) Linking ISSN: 00027863 NLM ISO Abbreviation: J Am Chem Soc Subsets: MEDLINE
Ιατρικοί όροι (MeSH): Molecular Structure* , Photochemical Processes*, Stereoisomerism ; Ultraviolet Rays
Συνδεδεμένο Πλήρες Κείμενο -
2Academic Journal
Συγγραφείς: Zalte AS; Department of Chemical Engineering, MIT, Cambridge, Massachusetts 02139, United States., Pang HW; Department of Chemical Engineering, MIT, Cambridge, Massachusetts 02139, United States., Doner AC; Department of Chemical Engineering, MIT, Cambridge, Massachusetts 02139, United States., Green WH; Department of Chemical Engineering, MIT, Cambridge, Massachusetts 02139, United States.
Πηγή: Journal of chemical information and modeling [J Chem Inf Model] 2025 Oct 27; Vol. 65 (20), pp. 10832-10843. Date of Electronic Publication: 2025 Oct 08.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: American Chemical Society Country of Publication: United States NLM ID: 101230060 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-960X (Electronic) Linking ISSN: 15499596 NLM ISO Abbreviation: J Chem Inf Model Subsets: MEDLINE
Ιατρικοί όροι (MeSH): Machine Learning* , Molecular Structure*, Neural Networks, Computer
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3Academic Journal
Συγγραφείς: Yang HY; Key Laboratory of Water Pollution Control and Wastewater Reuse of Anhui Province, Anhui Provincial Key Laboratory of Environmental Pollution Control and Resource Reuse, Anhui Jianzhu University, Hefei, China; State Key Laboratory of Advanced Environmental Technology Department of Environmental Science and Engineering, University of Science and Technology of China, Hefei, China; Pollution Control and Resource Utilization in Industrial Parks Joint Laboratory of Anhui Province, Hefei, China. Electronic address: younghy@ahjzu.edu.cn., Geng X; Key Laboratory of Water Pollution Control and Wastewater Reuse of Anhui Province, Anhui Provincial Key Laboratory of Environmental Pollution Control and Resource Reuse, Anhui Jianzhu University, Hefei, China; State Key Laboratory of Advanced Environmental Technology Department of Environmental Science and Engineering, University of Science and Technology of China, Hefei, China., Quan ZD; Key Laboratory of Water Pollution Control and Wastewater Reuse of Anhui Province, Anhui Provincial Key Laboratory of Environmental Pollution Control and Resource Reuse, Anhui Jianzhu University, Hefei, China., Yu L; Key Laboratory of Water Pollution Control and Wastewater Reuse of Anhui Province, Anhui Provincial Key Laboratory of Environmental Pollution Control and Resource Reuse, Anhui Jianzhu University, Hefei, China., Huang XH; Key Laboratory of Water Pollution Control and Wastewater Reuse of Anhui Province, Anhui Provincial Key Laboratory of Environmental Pollution Control and Resource Reuse, Anhui Jianzhu University, Hefei, China., Li WH; Key Laboratory of Water Pollution Control and Wastewater Reuse of Anhui Province, Anhui Provincial Key Laboratory of Environmental Pollution Control and Resource Reuse, Anhui Jianzhu University, Hefei, China., Xue TZ; Key Laboratory of Water Pollution Control and Wastewater Reuse of Anhui Province, Anhui Provincial Key Laboratory of Environmental Pollution Control and Resource Reuse, Anhui Jianzhu University, Hefei, China., Mu Y; State Key Laboratory of Advanced Environmental Technology Department of Environmental Science and Engineering, University of Science and Technology of China, Hefei, China.
Πηγή: Bioelectrochemistry (Amsterdam, Netherlands) [Bioelectrochemistry] 2026 Aug; Vol. 170, pp. 109229. Date of Electronic Publication: 2026 Jan 19.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: Netherlands NLM ID: 100953583 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1878-562X (Electronic) Linking ISSN: 15675394 NLM ISO Abbreviation: Bioelectrochemistry Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Azo Compounds*/chemistry , Azo Compounds*/metabolism , Azo Compounds*/isolation & purification , Electrochemical Techniques*/methods , Water Pollutants, Chemical*/chemistry , Water Pollutants, Chemical*/isolation & purification , Coloring Agents*/chemistry, Kinetics ; Electrodes ; Molecular Structure
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4Academic Journal
Συγγραφείς: Zhang X; Guangxi Key Laboratory of Clean Pulp & Papermaking and Pollution Control, College of Light Industry and Food Engineering, Guangxi University, Nanning, 530004, China., You Z; Guangxi Key Laboratory of Clean Pulp & Papermaking and Pollution Control, College of Light Industry and Food Engineering, Guangxi University, Nanning, 530004, China., Li Y; Guangxi Key Laboratory of Clean Pulp & Papermaking and Pollution Control, College of Light Industry and Food Engineering, Guangxi University, Nanning, 530004, China., Kang X; Guangxi Key Laboratory of Clean Pulp & Papermaking and Pollution Control, College of Light Industry and Food Engineering, Guangxi University, Nanning, 530004, China., Su T; Agricultural Resources and Environmental Research Institute, Guangxi Academy of Agricultural Sciences/Guangxi Key Laboratory of Arable Land Conservation, Nanning, 530007, China., Ragauskas AJ; Department of Chemical and Biomolecular Engineering, University of Tennessee, Knoxville, TN, USA; Joint Institute for Biological Sciences, Biosciences Division, Oak Ridge National Laboratory, Oak Ridge, TN, USA; Center for Renewable Carbon, Department of Forestry, Wildlife and Fisheries, The University of Tennessee, Knoxville, TN, 37996, USA., He T; Agricultural Resources and Environmental Research Institute, Guangxi Academy of Agricultural Sciences/Guangxi Key Laboratory of Arable Land Conservation, Nanning, 530007, China., Yuan Z; College of Materials Engineering, Fujian Agriculture & Forestry University, Fuzhou, 350108, China. Electronic address: zhanhuiyuan@fafu.edu.cn., Song X; Guangxi Key Laboratory of Clean Pulp & Papermaking and Pollution Control, College of Light Industry and Food Engineering, Guangxi University, Nanning, 530004, China. Electronic address: sx_ping@gxu.edu.cn.
Πηγή: International journal of biological macromolecules [Int J Biol Macromol] 2026 Jul; Vol. 371, pp. 152748. Date of Electronic Publication: 2026 May 26.
Τύπος έκδοσης: Journal Article; Review
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: Netherlands NLM ID: 7909578 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-0003 (Electronic) Linking ISSN: 01418130 NLM ISO Abbreviation: Int J Biol Macromol Subsets: MEDLINE
Ιατρικοί όροι (MeSH): Lignin*/chemistry , Sulfonic Acids*/chemistry, Molecular Structure
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5Academic Journal
Συγγραφείς: Hu J; Macromolecular Chemistry and New Polymeric Materials, Zernike Institute for Advanced Materials, University of Groningen, Nijenborgh 3, 9747AG Groningen, the Netherlands., Lu K; Macromolecular Chemistry and New Polymeric Materials, Zernike Institute for Advanced Materials, University of Groningen, Nijenborgh 3, 9747AG Groningen, the Netherlands; Circular Plastics, Academy Tech & Design, NHL Stenden University of Applied Sciences, Van Schaikweg 94, 7811 KL Emmen, the Netherlands., Giuntoli A; Micromechanics, Zernike Institute for Advanced Materials, University of Groningen, Nijenborgh 3, 9747AG Groningen, the Netherlands., Voet VSD; Circular Plastics, Academy Tech & Design, NHL Stenden University of Applied Sciences, Van Schaikweg 94, 7811 KL Emmen, the Netherlands., Folkersma R; Circular Plastics, Academy Tech & Design, NHL Stenden University of Applied Sciences, Van Schaikweg 94, 7811 KL Emmen, the Netherlands., Loos K; Macromolecular Chemistry and New Polymeric Materials, Zernike Institute for Advanced Materials, University of Groningen, Nijenborgh 3, 9747AG Groningen, the Netherlands., Maniar D; Macromolecular Chemistry and New Polymeric Materials, Zernike Institute for Advanced Materials, University of Groningen, Nijenborgh 3, 9747AG Groningen, the Netherlands. Electronic address: d.maniar@rug.nl.
Πηγή: Food chemistry [Food Chem] 2026 Aug 30; Vol. 521, pp. 149929. Date of Electronic Publication: 2026 Jun 03.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Applied Science Publishers Country of Publication: England NLM ID: 7702639 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1873-7072 (Electronic) Linking ISSN: 03088146 NLM ISO Abbreviation: Food Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Amylose*/chemistry , alpha-Linolenic Acid*/chemistry, Zea mays/chemistry ; Temperature ; Magnetic Resonance Spectroscopy ; Molecular Dynamics Simulation ; Molecular Structure
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6Academic Journal
Συγγραφείς: Ahmad MI; College of Biosystems Engineering and Food Science, Zhejiang Key Laboratory for Agro-Food Processing, Zhejiang University, Hangzhou, China., Zhou S; Wilmar (Shanghai) Biotechnology Research & Development Center Co. Ltd, Shanghai, China., Farooq S; College of Biosystems Engineering and Food Science, Zhejiang Key Laboratory for Agro-Food Processing, Zhejiang University, Hangzhou, China., Ali U; College of Biosystems Engineering and Food Science, Zhejiang Key Laboratory for Agro-Food Processing, Zhejiang University, Hangzhou, China., Li T; College of Biosystems Engineering and Food Science, Zhejiang Key Laboratory for Agro-Food Processing, Zhejiang University, Hangzhou, China., Zhang H; College of Biosystems Engineering and Food Science, Zhejiang Key Laboratory for Agro-Food Processing, Zhejiang University, Hangzhou, China.
Πηγή: Journal of the science of food and agriculture [J Sci Food Agric] 2026 Aug 30; Vol. 106 (11), pp. 6287-6298. Date of Electronic Publication: 2026 Feb 11.
Τύπος έκδοσης: Journal Article; Review
Στοιχεία περιοδικού: Publisher: John Wiley & Sons Country of Publication: England NLM ID: 0376334 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1097-0010 (Electronic) Linking ISSN: 00225142 NLM ISO Abbreviation: J Sci Food Agric Subsets: MEDLINE
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7Academic Journal
Συγγραφείς: Typek R; Department of Chromatography, Institute of Chemical Sciences, Faculty of Chemistry, Maria Curie Sklodowska University in Lublin, 20-031 Lublin, Poland., Dybowski MP; Department of Chromatography, Institute of Chemical Sciences, Faculty of Chemistry, Maria Curie Sklodowska University in Lublin, 20-031 Lublin, Poland., Dawidowicz AL; Department of Chromatography, Institute of Chemical Sciences, Faculty of Chemistry, Maria Curie Sklodowska University in Lublin, 20-031 Lublin, Poland. Electronic address: andrzej.dawidowicz@mail.umcs.pl., Holowinski P; Department of Chromatography, Institute of Chemical Sciences, Faculty of Chemistry, Maria Curie Sklodowska University in Lublin, 20-031 Lublin, Poland.
Πηγή: Food chemistry [Food Chem] 2026 Aug 15; Vol. 520, pp. 149882. Date of Electronic Publication: 2026 May 30.
Τύπος έκδοσης: Journal Article; Evaluation Study
Στοιχεία περιοδικού: Publisher: Elsevier Applied Science Publishers Country of Publication: England NLM ID: 7702639 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1873-7072 (Electronic) Linking ISSN: 03088146 NLM ISO Abbreviation: Food Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Propiophenones*/chemistry , Flavonoids*/chemistry , Humulus*/chemistry , Plant Extracts*/chemistry, Chromatography, Gas/methods ; Beer/analysis ; Cyclization ; Molecular Structure
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8Academic Journal
Συγγραφείς: Geng S; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China; Henan Advanced Agriculture and Future Foods Research Association, Zhengzhou 450046, China., Liu G; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China., Bai L; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China., Wang C; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China., Yang W; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China., Jia Y; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China., Liu H; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China., Liu B; School of Food Science, Henan Institute of Science and Technology, Xinxiang 453003, China. Electronic address: liubenguo@hist.edu.cn.
Πηγή: Food chemistry [Food Chem] 2026 Aug 15; Vol. 520, pp. 149859. Date of Electronic Publication: 2026 May 28.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Applied Science Publishers Country of Publication: England NLM ID: 7702639 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1873-7072 (Electronic) Linking ISSN: 03088146 NLM ISO Abbreviation: Food Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Flavonoids*/chemistry , Muramidase*/chemistry, Quantitative Structure-Activity Relationship ; Molecular Dynamics Simulation ; Spectrometry, Fluorescence ; Hydrogen Bonding ; Protein Binding ; Hydrophobic and Hydrophilic Interactions ; Animals ; Molecular Structure
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9Academic Journal
Συγγραφείς: Fu Y; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China., Dong Y; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China., Miao J; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China., Fan X; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China., Li D; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China., Chen Y; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China., Ye X; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China; College of Biosystems Engineering and Food Science, Zhejiang University, Hangzhou 310058, Zhejiang, PR China., Zhu Y; Zhejiang University Zhongyuan Institute, Zhengzhou 450001, Henan, PR China; College of Biosystems Engineering and Food Science, Zhejiang University, Hangzhou 310058, Zhejiang, PR China. Electronic address: 11813043@zju.edu.cn.
Πηγή: Food chemistry [Food Chem] 2026 Aug 15; Vol. 520, pp. 149830. Date of Electronic Publication: 2026 May 27.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Applied Science Publishers Country of Publication: England NLM ID: 7702639 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1873-7072 (Electronic) Linking ISSN: 03088146 NLM ISO Abbreviation: Food Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Anthocyanins*/chemistry , Flavonoids*/chemistry, Kinetics ; Molecular Structure ; Thermodynamics
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10Academic Journal
Συγγραφείς: Yang S; Department of Pharmaceutical Engineering, School of Chemical Engineering, Northwest University, 229 Taibai North Road, Xi'an 710069, China., Zhang Y; Department of Pharmaceutical Engineering, School of Chemical Engineering, Northwest University, 229 Taibai North Road, Xi'an 710069, China., Song X; Department of Pharmaceutical Engineering, School of Chemical Engineering, Northwest University, 229 Taibai North Road, Xi'an 710069, China., Liu Q; Department of Pharmaceutical Engineering, School of Chemical Engineering, Northwest University, 229 Taibai North Road, Xi'an 710069, China. Electronic address: liuqc21@nwu.edu.cn., Fan D; Department of Pharmaceutical Engineering, School of Chemical Engineering, Northwest University, 229 Taibai North Road, Xi'an 710069, China; Engineering Research Center of Western Resource Innovation Medicine Green Manufacturing, Ministry of Education, School of Chemical Engineering, Northwest University, Xi'an 710069, China. Electronic address: fandaidi@nwu.edu.cn., Xu Y; Department of Pharmaceutical Engineering, School of Chemical Engineering, Northwest University, 229 Taibai North Road, Xi'an 710069, China. Electronic address: xuying@nwu.edu.cn.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109968. Date of Electronic Publication: 2026 May 10.
Τύπος έκδοσης: Journal Article; Review
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Ubiquitin-Protein Ligases*/metabolism , Adaptor Proteins, Signal Transducing*/metabolism, Proteolysis/drug effects ; Ligands ; Humans ; Proteolysis Targeting Chimera ; Structure-Activity Relationship ; Molecular Structure ; Animals
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11Academic Journal
Συγγραφείς: Lai Y; Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China., Liu R; School of Stomatology, Nanchang University, Nanchang, Jiangxi Province 330006, China., Zhou L; Department of Otorhinolaryngology, Affiliated Hospital of Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China., Wan Z; Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China; Department of Otorhinolaryngology, Affiliated Hospital of Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China., Zhan J; Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China., Xiong M; Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China., Jiang L; Department of Oral and Maxillofacial Surgery, Key Laboratory of Oral Diseases of Traditional Chinese Medicine, Affiliated Hospital of Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China., Wang W; Department of Oral and Maxillofacial Surgery, Key Laboratory of Oral Diseases of Traditional Chinese Medicine, Affiliated Hospital of Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China., Shao Y; Department of Oral and Maxillofacial Surgery, Key Laboratory of Oral Diseases of Traditional Chinese Medicine, Affiliated Hospital of Jiangxi University of Chinese Medicine, Nanchang, Jiangxi Province 330006, China. Electronic address: shaoyisen@jxutcm.edu.cn.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109983. Date of Electronic Publication: 2026 May 12.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Saponins*/pharmacology , Saponins*/chemistry , Mouth Neoplasms*/drug therapy , Mouth Neoplasms*/pathology , Mouth Neoplasms*/metabolism , Plant Oils*/chemistry , Plant Oils*/pharmacology , Antineoplastic Agents, Phytogenic*/pharmacology , Antineoplastic Agents, Phytogenic*/chemistry , Antineoplastic Agents, Phytogenic*/isolation & purification, CDC2 Protein Kinase/metabolism ; CDC2 Protein Kinase/antagonists & inhibitors ; Cell Proliferation/drug effects ; Homeodomain Proteins/metabolism ; Homeodomain Proteins/antagonists & inhibitors ; Homeodomain Proteins/genetics ; Emulsions/chemistry ; Emulsions/pharmacology ; Humans ; Animals ; Mice ; Mice, Nude ; Dose-Response Relationship, Drug ; Mice, Inbred BALB C ; Drug Screening Assays, Antitumor ; Structure-Activity Relationship ; Molecular Structure
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12Academic Journal
Συγγραφείς: Faleye OO; School of Chemical Engineering, Yeungnam University, 280 Daehak-Ro, Gyeongsan 38541, Republic of Korea., Mukhles MB; School of Chemical Engineering, Yeungnam University, 280 Daehak-Ro, Gyeongsan 38541, Republic of Korea., Boya BR; School of Chemical Engineering, Yeungnam University, 280 Daehak-Ro, Gyeongsan 38541, Republic of Korea., Kim YG; School of Chemical Engineering, Yeungnam University, 280 Daehak-Ro, Gyeongsan 38541, Republic of Korea., Lee JH; School of Chemical Engineering, Yeungnam University, 280 Daehak-Ro, Gyeongsan 38541, Republic of Korea. Electronic address: jinhlee@ynu.ac.kr., Lee J; School of Chemical Engineering, Yeungnam University, 280 Daehak-Ro, Gyeongsan 38541, Republic of Korea. Electronic address: jtlee@ynu.ac.kr.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109971. Date of Electronic Publication: 2026 May 08.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Antifungal Agents*/pharmacology , Antifungal Agents*/chemistry , Antifungal Agents*/chemical synthesis , Candida albicans*/drug effects , Drug Resistance, Fungal*/drug effects , Dibenzofurans*/pharmacology , Dibenzofurans*/chemistry , Dibenzofurans*/chemical synthesis , Benzofurans*/pharmacology , Benzofurans*/chemistry , Benzofurans*/chemical synthesis, Biofilms/drug effects ; Microbial Sensitivity Tests ; Structure-Activity Relationship ; Dose-Response Relationship, Drug ; Humans ; Molecular Structure ; Animals
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13Academic Journal
Συγγραφείς: Mondal SK; Indian Institute of Technology Bhubaneswar, Department of Chemistry, Jatni, Khordha, Odisha 752050, India., Samantaray S; Institute of Life Sciences (ILS), Department of Biotechnology, NALCO Nagar, Bhubaneswar, Odisha 751023, India., Sahoo AS; Institute of Life Sciences (ILS), Department of Biotechnology, NALCO Nagar, Bhubaneswar, Odisha 751023, India., Mohapatra A; Thapar Institute of Engineering and Technology (TIET), School of Chemistry and Biochemistry, Patiala 147004, Punjab, India., Syed GH; Institute of Life Sciences (ILS), Department of Biotechnology, NALCO Nagar, Bhubaneswar, Odisha 751023, India. Electronic address: gulamsyed@ils.res.in., Pal S; Indian Institute of Technology Bhubaneswar, Department of Chemistry, Jatni, Khordha, Odisha 752050, India. Electronic address: spal@iitbbs.ac.in.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109961. Date of Electronic Publication: 2026 May 09.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Antiviral Agents*/pharmacology , Antiviral Agents*/chemistry , Antiviral Agents*/chemical synthesis , Dengue Virus*/drug effects , Purine Nucleosides*/pharmacology , Purine Nucleosides*/chemistry , Purine Nucleosides*/chemical synthesis , Drug Discovery*, Humans ; Structure-Activity Relationship ; Molecular Docking Simulation ; Molecular Structure ; Microbial Sensitivity Tests ; Dose-Response Relationship, Drug
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14Academic Journal
Συγγραφείς: Kong F; School of Basic Medical Sciences, Hebei University, Baoding, China; Tianjin Key Laboratory of Biomedical Materials, Institute of Biomedical Engineering, Chinese Academy of Medical Sciences and Peking Union Medical College, China., Zhang T; School of Basic Medical Sciences, Hebei University, Baoding, China., Liu Y; The Second Surgical Department of Breast Cancer, Tianjin Medical University Cancer Institute and Hospital, National Clinical Research Center for Cancer, Tianjin, China., Li Y; School of Clinical Medicine, Hebei University, Baoding, China., Liu X; School of Basic Medical Sciences, Hebei University, Baoding, China., Bai C; School of Basic Medical Sciences, Hebei University, Baoding, China., Wang T; School of Clinical Medicine, Hebei University, Baoding, China., Zhao Z; School of Basic Medical Sciences, Hebei University, Baoding, China. Electronic address: zhaozhanjuanv@163.con., Hong G; Tianjin Key Laboratory of Biomedical Materials, Institute of Biomedical Engineering, Chinese Academy of Medical Sciences and Peking Union Medical College, China. Electronic address: hongge@bme.pumc.edu.cn.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109955. Date of Electronic Publication: 2026 May 09.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Anti-Bacterial Agents*/pharmacology , Anti-Bacterial Agents*/chemistry , Pseudomonas aeruginosa*/drug effects , Diabetes Mellitus, Experimental*/drug therapy , Wound Infection*/drug therapy , Wound Infection*/microbiology , Pseudomonas Infections*/drug therapy , Ceftazidime*/pharmacology , Ceftazidime*/chemistry , Photosensitizing Agents*/pharmacology , Photosensitizing Agents*/chemistry , Aminolevulinic Acid*/pharmacology , Aminolevulinic Acid*/chemistry , Photochemotherapy*, Drug Resistance, Multiple, Bacterial/drug effects ; Wound Healing/drug effects ; Animals ; Rats ; Microbial Sensitivity Tests ; Male ; Rats, Sprague-Dawley ; Dose-Response Relationship, Drug ; Drug Therapy, Combination ; Structure-Activity Relationship ; Molecular Structure
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15Academic Journal
Συγγραφείς: Yue L; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China., Li Y; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China., Gan C; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China. Electronic address: gancailing@scu.edu.cn., Sun M; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China., Deng C; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China., Xue T; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China., Xie Y; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China., Liu H; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China., Liu Z; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China. Electronic address: liuzhihao@scu.edu.cn., Ye T; Department of High Altitude Medicine, Center for High Altitude Medicine, Department of Emergency Medicine, Institute of Disaster Medicine and Institute of Emergency Medicine, State Key Laboratory of Biotherapy, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China; Institute of High Altitude Medicine, High Altitude Medicine Key Laboratory of Sichuan Province, West China Hospital, Sichuan University, Chengdu, Sichuan 610041, China; Xi Zang Hospital of West China Hospital, Sichuan University, Lhasa, Xizang, 850000, China. Electronic address: yeth1309@scu.edu.cn.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109945. Date of Electronic Publication: 2026 May 06.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Pulmonary Fibrosis*/drug therapy , Pulmonary Fibrosis*/metabolism , Pulmonary Fibrosis*/pathology , Receptor, Transforming Growth Factor-beta Type I*/antagonists & inhibitors , Receptor, Transforming Growth Factor-beta Type I*/metabolism , Protein Kinase Inhibitors*/chemical synthesis , Protein Kinase Inhibitors*/pharmacology , Protein Kinase Inhibitors*/chemistry , Drug Design*, Proteolysis/drug effects ; Animals ; Mice ; Proteolysis Targeting Chimera ; NIH 3T3 Cells ; Humans ; Structure-Activity Relationship ; Molecular Structure ; Dose-Response Relationship, Drug
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16Academic Journal
Συγγραφείς: Labović M; Department of General Practice, Centre for Military Medical Institutions 'Slavija', Belgrade, Serbia; Department of Pharmacology, Clinical Pharmacology and Toxicology, Faculty of Medicine, University of Belgrade, Belgrade, Serbia., Milenković MR; University of Belgrade, Faculty of Chemistry, Belgrade, Serbia., Bajuk-Bogdanović D; University of Belgrade, Faculty of Physical Chemistry, Belgrade, Serbia., Milenković MT; Department of Microbiology and Immunology, Faculty of Pharmacy, University of Belgrade, Belgrade, Serbia., Gligorijević N; Institute for Oncology and Radiology of Serbia, Belgrade, Serbia., Popović Bijelić A; University of Belgrade, Faculty of Physical Chemistry, Belgrade, Serbia., Božić Cvijan B; Department of Pharmacology, Clinical Pharmacology and Toxicology, Faculty of Medicine, University of Belgrade, Belgrade, Serbia. Electronic address: bojana.bozic@med.bg.ac.rs., Korać Jačić J; Department of Life Sciences, Institute for Multidisciplinary Research, National Institute of the Republic of Serbia, University of Belgrade, Belgrade, Serbia. Electronic address: jskorac@imsi.bg.ac.rs.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109947. Date of Electronic Publication: 2026 May 04.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Copper*/metabolism , Copper*/chemistry , Copper*/pharmacology , Levofloxacin*/pharmacology , Levofloxacin*/chemistry , Anti-Bacterial Agents*/pharmacology , Anti-Bacterial Agents*/chemistry , Anti-Bacterial Agents*/chemical synthesis , Streptococcus pneumoniae*/drug effects , Pneumococcal Infections*/drug therapy , Antineoplastic Agents*/pharmacology , Antineoplastic Agents*/chemistry, Coordination Complexes/pharmacology ; Coordination Complexes/chemistry ; Cell Survival/drug effects ; Hydrogen-Ion Concentration ; Humans ; Microbial Sensitivity Tests ; Dose-Response Relationship, Drug ; Structure-Activity Relationship ; Molecular Structure
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17Academic Journal
Συγγραφείς: Dimitrijevs P; Latvian Institute of Organic Synthesis, Aizkraukles 21, LV1006, Riga, Latvia., Makrecka-Kuka M; Latvian Institute of Organic Synthesis, Aizkraukles 21, LV1006, Riga, Latvia., Zelencova-Gopejenko D; Latvian Institute of Organic Synthesis, Aizkraukles 21, LV1006, Riga, Latvia., Rudevica Z; Latvian Biomedical Research and Study Centre, LV-1067, Riga, Latvia., Korotkaja K; Latvian Biomedical Research and Study Centre, LV-1067, Riga, Latvia., Zajakina A; Latvian Biomedical Research and Study Centre, LV-1067, Riga, Latvia., Rudzitis K; Latvian Institute of Organic Synthesis, Aizkraukles 21, LV1006, Riga, Latvia., Bogucka A; Department of Biochemistry, Sanger Building, 80 Tennis Ct Rd, Cambridge, CB2 1GA, University of Cambridge, UK., Hyvönen M; Department of Biochemistry, Sanger Building, 80 Tennis Ct Rd, Cambridge, CB2 1GA, University of Cambridge, UK., Pantelejevs T; Latvian Institute of Organic Synthesis, Aizkraukles 21, LV1006, Riga, Latvia., Arsenyan P; Latvian Institute of Organic Synthesis, Aizkraukles 21, LV1006, Riga, Latvia. Electronic address: pavel@osi.lv.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109962. Date of Electronic Publication: 2026 May 09.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Poly (ADP-Ribose) Polymerase-1*/metabolism , Poly (ADP-Ribose) Polymerase-1*/antagonists & inhibitors , Poly(ADP-ribose) Polymerase Inhibitors*/pharmacology , Poly(ADP-ribose) Polymerase Inhibitors*/chemistry , Poly(ADP-ribose) Polymerase Inhibitors*/chemical synthesis , Carrier Proteins*/metabolism , Carrier Proteins*/antagonists & inhibitors , Antineoplastic Agents*/pharmacology , Antineoplastic Agents*/chemistry , Antineoplastic Agents*/chemical synthesis , Thyroid Hormones*/metabolism , Membrane Proteins*/metabolism , Membrane Proteins*/antagonists & inhibitors , Organoselenium Compounds*/pharmacology , Organoselenium Compounds*/chemistry , Piperazines*/pharmacology , Piperazines*/chemistry, Cell Proliferation/drug effects ; Humans ; Thyroid Hormone-Binding Proteins ; Structure-Activity Relationship ; Molecular Structure ; Dose-Response Relationship, Drug ; Drug Screening Assays, Antitumor ; Cell Line, Tumor
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18Academic Journal
Συγγραφείς: Zhao H; National & Local Joint Engineering Research Center for the Exploitation of Homology Resources of Southwest Medicine and Food, Guizhou University, Guiyang 550025, China., Long D; National & Local Joint Engineering Research Center for the Exploitation of Homology Resources of Southwest Medicine and Food, Guizhou University, Guiyang 550025, China., Jin L; National & Local Joint Engineering Research Center for the Exploitation of Homology Resources of Southwest Medicine and Food, Guizhou University, Guiyang 550025, China., Zhao X; Guizhou University of Traditional Chinese Medicine, Guiyang 550025, China., Zhang T; Guizhou University of Traditional Chinese Medicine, Guiyang 550025, China., Hong Y; National & Local Joint Engineering Research Center for the Exploitation of Homology Resources of Southwest Medicine and Food, Guizhou University, Guiyang 550025, China., Tian M; National & Local Joint Engineering Research Center for the Exploitation of Homology Resources of Southwest Medicine and Food, Guizhou University, Guiyang 550025, China; Guizhou University of Traditional Chinese Medicine, Guiyang 550025, China. Electronic address: mytian@gzu.edu.cn., Zhou Y; National & Local Joint Engineering Research Center for the Exploitation of Homology Resources of Southwest Medicine and Food, Guizhou University, Guiyang 550025, China; Guizhou University of Traditional Chinese Medicine, Guiyang 550025, China. Electronic address: yingzhou71@yeah.net.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109974. Date of Electronic Publication: 2026 May 09.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Flowers*/chemistry , Colitis*/drug therapy , Colitis*/chemically induced , Colitis*/pathology , Colitis*/metabolism , Zingiberaceae*/chemistry , Phytochemicals*/pharmacology , Phytochemicals*/chemistry , Phytochemicals*/isolation & purification , Plant Extracts*/chemistry , Plant Extracts*/pharmacology , Plant Extracts*/isolation & purification , Anti-Inflammatory Agents, Non-Steroidal*/pharmacology , Anti-Inflammatory Agents, Non-Steroidal*/chemistry , Anti-Inflammatory Agents, Non-Steroidal*/isolation & purification , Anti-Inflammatory Agents*/pharmacology , Anti-Inflammatory Agents*/chemistry , Anti-Inflammatory Agents*/isolation & purification, Lipopolysaccharides/antagonists & inhibitors ; Lipopolysaccharides/pharmacology ; Cytokines/metabolism ; Cytokines/antagonists & inhibitors ; NF-kappa B/metabolism ; Animals ; Mice ; RAW 264.7 Cells ; Dextran Sulfate ; Male ; Dose-Response Relationship, Drug ; Molecular Structure ; Structure-Activity Relationship ; Mice, Inbred C57BL
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19Academic Journal
Συγγραφείς: Luo W; Department of Nuclear Medicine, The Second Affiliated Hospital of Chengdu Medical College, China National Nuclear Corporation 416 Hospital, No. 4, Fourth Section, North Ring Road, Chenghua District, Chengdu 610051, Sichuan, China., Zhang X; Department of Nuclear Medicine, The Second Affiliated Hospital of Chengdu Medical College, China National Nuclear Corporation 416 Hospital, No. 4, Fourth Section, North Ring Road, Chenghua District, Chengdu 610051, Sichuan, China., Liu Q; Department of Nuclear Medicine, The Second Affiliated Hospital of Chengdu Medical College, China National Nuclear Corporation 416 Hospital, No. 4, Fourth Section, North Ring Road, Chenghua District, Chengdu 610051, Sichuan, China., Shi Y; Department of Nuclear Medicine, The Second Affiliated Hospital of Chengdu Medical College, China National Nuclear Corporation 416 Hospital, No. 4, Fourth Section, North Ring Road, Chenghua District, Chengdu 610051, Sichuan, China. Electronic address: shiyuhong89@126.com., Jiang X; Department of Nuclear Medicine, The Second Affiliated Hospital of Chengdu Medical College, China National Nuclear Corporation 416 Hospital, No. 4, Fourth Section, North Ring Road, Chenghua District, Chengdu 610051, Sichuan, China. Electronic address: jiangxue1986Hh@163.com.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109980. Date of Electronic Publication: 2026 May 10.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Thyroid Neoplasms*/drug therapy , Thyroid Neoplasms*/diagnostic imaging , Thyroid Neoplasms*/metabolism , Thyroid Neoplasms*/radiotherapy , Thyroid Neoplasms*/pathology , Fibronectins*/antagonists & inhibitors , Fibronectins*/immunology , Fibronectins*/metabolism , Antineoplastic Agents*/pharmacology , Antineoplastic Agents*/chemistry , Antineoplastic Agents*/chemical synthesis , Immunoglobulin Fragments*/chemistry , Immunoglobulin Fragments*/pharmacology , Radiopharmaceuticals*/chemistry , Radiopharmaceuticals*/pharmacology , Theranostic Nanomedicine*, Lutetium/chemistry ; Zirconium/chemistry ; Cell Proliferation/drug effects ; Radioisotopes/chemistry ; Humans ; Animals ; Mice ; Iodine Radioisotopes ; Tissue Distribution ; Mice, Nude ; Drug Screening Assays, Antitumor ; Mice, Inbred BALB C ; Drug Evaluation, Preclinical ; Dose-Response Relationship, Drug ; Molecular Structure ; Structure-Activity Relationship ; Cell Line, Tumor
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20Academic Journal
Συγγραφείς: Xin XY; Engineering Research Center of North-East Cold Region Beef Cattle Science & Technology Innovation, Ministry of Education, Jilin Beef Cattle Science and industrial technology major demand collaborative Innovation Center, Department of Animal Science, Yanbian University, Yanji, 133002, China., Park S; Department of Food Science and Biotechnology, Sejong University, Seoul, 05006, Republic of Korea., Wang HW; Engineering Research Center of North-East Cold Region Beef Cattle Science & Technology Innovation, Ministry of Education, Jilin Beef Cattle Science and industrial technology major demand collaborative Innovation Center, Department of Animal Science, Yanbian University, Yanji, 133002, China., Hur S; Department of Animal Science and Technology, Chung-Ang University, Anseong, 17546, Republic of Korea., Li XZ; Engineering Research Center of North-East Cold Region Beef Cattle Science & Technology Innovation, Ministry of Education, Jilin Beef Cattle Science and industrial technology major demand collaborative Innovation Center, Department of Animal Science, Yanbian University, Yanji, 133002, China. Electronic address: lxz@ybu.edu.cn., Choi S; Department of Animal Science, Chungbuk National University, Cheongju, 28644, Republic of Korea. Electronic address: seongho@cbnu.ac.kr.
Πηγή: Bioorganic chemistry [Bioorg Chem] 2026 Aug 15; Vol. 178, pp. 109963. Date of Electronic Publication: 2026 May 08.
Τύπος έκδοσης: Journal Article
Στοιχεία περιοδικού: Publisher: Elsevier Country of Publication: United States NLM ID: 1303703 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2120 (Electronic) Linking ISSN: 00452068 NLM ISO Abbreviation: Bioorg Chem Subsets: MEDLINE
Συνδεδεμένο Πλήρες ΚείμενοΙατρικοί όροι (MeSH): Oxidative Stress*/drug effects , Inflammation*/drug therapy , Inflammation*/metabolism , Peptides*/chemistry , Peptides*/pharmacology , Quantum Theory*, Lipopolysaccharides/pharmacology ; Lipopolysaccharides/antagonists & inhibitors ; Toll-Like Receptor 4/metabolism ; Animals ; Mice ; RAW 264.7 Cells ; Structure-Activity Relationship ; Molecular Structure ; Dose-Response Relationship, Drug ; Molecular Docking Simulation ; Density Functional Theory