المؤلفون: Li B; School of Chemistry and Chemical Engineering, Guangxi University, Nanning, P. R. China., Yin X; School of Chemistry and Chemical Engineering, Guangxi University, Nanning, P. R. China., Cen B; School of Chemistry and Chemical Engineering, Guangxi University, Nanning, P. R. China., Duan W; School of Chemistry and Chemical Engineering, Guangxi University, Nanning, P. R. China., Lin G; School of Chemistry and Chemical Engineering, Guangxi University, Nanning, P. R. China., Wang X; School of Chemistry and Chemical Engineering, Guangxi University, Nanning, P. R. China., Zou R; School of Chemistry and Chemical Engineering, Guangxi University, Nanning, P. R. China.

المصدر: Natural product research [Nat Prod Res] 2024 Jan-Feb; Vol. 38 (2), pp. 359-364. Date of Electronic Publication: 2022 Aug 25.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: Taylor & Francis Health Sciences Country of Publication: England NLM ID: 101167924 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1478-6427 (Electronic) Linking ISSN: 14786419 NLM ISO Abbreviation: Nat Prod Res Subsets: MEDLINE

مواضيع طبية MeSH: Quantitative Structure-Activity Relationship* , Herbicides*/chemistry, Sulfides ; Spectroscopy, Fourier Transform Infrared ; Structure-Activity Relationship

المؤلفون: Rodrigues Gazolla PA; Grupo de Pesquisa e Síntese de Compostos Bioativos (GSPCB), Departamento de Química, Universidade Federal de Viçosa, Viçosa-MG, 36570-900, Brazil., Lima WP; Escola de Ciências da Saúde, Universidade do Grande Rio, Rio de Janeiro-RJ, 22775-003, Brazil., de Aguiar AR; Grupo de Pesquisa e Síntese de Compostos Bioativos (GSPCB), Departamento de Química, Universidade Federal de Viçosa, Viçosa-MG, 36570-900, Brazil., Gonçalves Borsodi MP; Instituto de Biofísica Carlos Chagas Filho, Universidade Federal do Rio de Janeiro, Rio de Janeiro, 21941-902, Brazil., Costa AV; Departamento de Química e Física, Universidade Federal do Espírito Santo, Alegre-ES, 29500-000, Brazil., de Oliveira FM; Instituto Federal de Minas Gerais (IFMG), Campus Ouro Branco, Ouro Branco-MG, 36494-018, Brazil., de Oliveira OV; Instituto Federal de São Paulo - Campus Catanduva, Catanduva-SP, 15808-305, Brazil., Andreazza Costa MC; Instituto de Química, Universidade Estadual de Campinas, Campinas-SP, 13083-970, Brazil., Castro Ferreira MM; Instituto de Química, Universidade Estadual de Campinas, Campinas-SP, 13083-970, Brazil., do Nascimento CJ; Departamento de Ciências Naturais, Instituto de Biociências, Universidade Federal do Estado do Rio de Janeiro (UNIRIO), Rio de Janeiro-RJ, 22290-240, Brazil., Junker J; Centro de Desenvolvimento Tecnológico em Saúde, Fundação Oswaldo Cruz, Rio de Janeiro-RJ, 21040-361, Brazil., Vaz BG; Instituto de Química, Universidade Federal de Goiás, Goiânia-GO, 74001-970, Brazil., Teixeira RR; Grupo de Pesquisa e Síntese de Compostos Bioativos (GSPCB), Departamento de Química, Universidade Federal de Viçosa, Viçosa-MG, 36570-900, Brazil.

المصدر: Future medicinal chemistry [Future Med Chem] 2024 Jan; Vol. 16 (2), pp. 139-155. Date of Electronic Publication: 2023 Dec 22.

نوع المنشور: Journal Article; Research Support, Non-U.S. Gov't

بيانات الدورية: Publisher: Future Science Country of Publication: England NLM ID: 101511162 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1756-8927 (Electronic) Linking ISSN: 17568919 NLM ISO Abbreviation: Future Med Chem Subsets: MEDLINE

مواضيع طبية MeSH: Quantitative Structure-Activity Relationship* , Antiprotozoal Agents*/pharmacology , Antiprotozoal Agents*/chemistry , Benzaldehydes*, Humans ; Molecular Docking Simulation ; Triazoles/pharmacology ; Sterols ; Structure-Activity Relationship

المؤلفون: Mughal EU; Department of Chemistry, University of Gujrat, Gujrat, Pakistan., Amjid S; Department of Chemistry, University of Gujrat, Gujrat, Pakistan., Sadiq A; Department of Chemistry, Govt. College Women University, Sialkot, Pakistan., Naeem N; Department of Chemistry, University of Gujrat, Gujrat, Pakistan., Nazir Y; Department of Chemistry, Allama Iqbal Open University, Islamabad, Pakistan., Alrafai HA; Department of Chemistry, Faculty of Science, King Khalid University, Abraham, Saudi Arabia., Hassan AA; Department of Chemistry, Faculty of Science, King Khalid University, Abraham, Saudi Arabia., Al-Nami SY; Department of Chemistry, Faculty of Science, King Khalid University, Abraham, Saudi Arabia., Abdel Hafez AA; Department of Chemistry, Faculty of Science, King Khalid University, Abraham, Saudi Arabia., Ali Shah SW; Department of Pharmacy, University of Malakand, Chakdara Dir, Khyber Pakhtunkhwa, Pakistan., Ghias M; Department of Pharmacy, University of Malakand, Chakdara Dir, Khyber Pakhtunkhwa, Pakistan.

المصدر: Journal of biomolecular structure & dynamics [J Biomol Struct Dyn] 2024 Jan-Feb; Vol. 42 (1), pp. 244-260. Date of Electronic Publication: 2023 Apr 25.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: Taylor & Francis Country of Publication: England NLM ID: 8404176 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1538-0254 (Electronic) Linking ISSN: 07391102 NLM ISO Abbreviation: J Biomol Struct Dyn Subsets: MEDLINE

مواضيع طبية MeSH: Quantitative Structure-Activity Relationship* , Molecular Dynamics Simulation*, Molecular Docking Simulation ; alpha-Glucosidases/chemistry ; Structure-Activity Relationship ; alpha-Amylases ; Molecular Structure

المؤلفون: Chen S; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Wang S; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Zheng J; Department of Anesthesiology and Perioperative Medicine, The Second Affiliated Hospital and Yuying Children's Hospital, Key Laboratory of Pediatric Anesthesiology, Ministry of Education, Key Laboratory of Anesthesiology of Zhejiang Province, Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Lu H; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Chen H; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Tang Y; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Wang N; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Zhu Y; Department of Anesthesiology and Perioperative Medicine, The Second Affiliated Hospital and Yuying Children's Hospital, Key Laboratory of Pediatric Anesthesiology, Ministry of Education, Key Laboratory of Anesthesiology of Zhejiang Province, Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Wang Y; Department of Anesthesiology and Perioperative Medicine, The Second Affiliated Hospital and Yuying Children's Hospital, Key Laboratory of Pediatric Anesthesiology, Ministry of Education, Key Laboratory of Anesthesiology of Zhejiang Province, Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China., Duan P; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China. Electronic address: dppddpp@wmu.edu.cn., Ge RS; Department of Obstetrics and Gynecology, The Second Affiliated Hospital and Yuying Children's Hospital of Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China; Department of Anesthesiology and Perioperative Medicine, The Second Affiliated Hospital and Yuying Children's Hospital, Key Laboratory of Pediatric Anesthesiology, Ministry of Education, Key Laboratory of Anesthesiology of Zhejiang Province, Wenzhou Medical University, Wenzhou, Zhejiang, 325027, China; Key Laboratory of Structural Malformations in Children of Zhejiang Province and Key Laboratory of Male Health and Environment of Wenzhou, 325000, Zhejiang Province, China. Electronic address: renshan_ge@wmu.edu.cn.

المصدر: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association [Food Chem Toxicol] 2023 Nov; Vol. 181, pp. 114052. Date of Electronic Publication: 2023 Sep 26.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: Elsevier Science Ltd Country of Publication: England NLM ID: 8207483 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1873-6351 (Electronic) Linking ISSN: 02786915 NLM ISO Abbreviation: Food Chem Toxicol Subsets: MEDLINE

مواضيع طبية MeSH: Quantitative Structure-Activity Relationship* , Enzyme Inhibitors*/pharmacology, Humans ; Female ; Pregnancy ; Animals ; Rats ; Models, Molecular ; Placenta ; Estrone/chemistry ; Estrone/pharmacology ; Structure-Activity Relationship

المؤلفون: Capucho LR; Departamento de Química, Instituto de Ciências Naturais, Universidade Federal de Lavras, Lavras, Brazil., Pereira IV; Departamento de Química, Instituto de Ciências Naturais, Universidade Federal de Lavras, Lavras, Brazil., de Faria AC; Departamento de Química, Instituto de Ciências Naturais, Universidade Federal de Lavras, Lavras, Brazil., Daré JK; Departamento de Química, Instituto de Ciências Naturais, Universidade Federal de Lavras, Lavras, Brazil., da Cunha EFF; Departamento de Química, Instituto de Ciências Naturais, Universidade Federal de Lavras, Lavras, Brazil., Freitas MP; Departamento de Química, Instituto de Ciências Naturais, Universidade Federal de Lavras, Lavras, Brazil.

المصدر: Journal of the science of food and agriculture [J Sci Food Agric] 2023 Aug 30; Vol. 103 (11), pp. 5231-5241. Date of Electronic Publication: 2023 Apr 18.

نوع المنشور: Journal Article

بيانات الدورية: 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

مواضيع طبية MeSH: Quantitative Structure-Activity Relationship* , 4-Hydroxyphenylpyruvate Dioxygenase*/chemistry , 4-Hydroxyphenylpyruvate Dioxygenase*/metabolism, Molecular Structure ; Structure-Activity Relationship ; Enzyme Inhibitors/chemistry

المؤلفون: Silva JV; Department of Pharmacy, School of Pharmaceutical Sciences, University of São Paulo, São Paulo, Brazil., Sueyoshi S; Department of Pharmacy, School of Pharmaceutical Sciences, University of São Paulo, São Paulo, Brazil., Snape TJ; Leicester School of Pharmacy, De Montfort University, Leicester, UK., Lal S; Amity Institute of Pharmacy, Amity University, Gurugram, India., Giarolla J; Department of Pharmacy, School of Pharmaceutical Sciences, University of São Paulo, São Paulo, Brazil.

المصدر: SAR and QSAR in environmental research [SAR QSAR Environ Res] 2023 Jul-Sep; Vol. 34 (8), pp. 661-687. Date of Electronic Publication: 2023 Aug 22.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: Taylor & Francis Country of Publication: England NLM ID: 9440156 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1029-046X (Electronic) Linking ISSN: 1026776X NLM ISO Abbreviation: SAR QSAR Environ Res Subsets: MEDLINE

مواضيع طبية MeSH: Quantitative Structure-Activity Relationship* , Oxidoreductases*/chemistry, Molecular Docking Simulation ; Structure-Activity Relationship

المؤلفون: Wang S; Key Laboratory of Structure-Based Drug Design & Discovery of Ministry of Education, Shenyang Pharmaceutical University, Shenyang 110016, China; Key Laboratory of Intelligent Drug Design and New Drug Discovery of Liaoning Province, Shenyang Pharmaceutical University, Shenyang 110016, China; School of Pharmaceutical Engineering, Shenyang Pharmaceutical University, Shenyang 110016, China., Luan J; Key Laboratory of Structure-Based Drug Design & Discovery of Ministry of Education, Shenyang Pharmaceutical University, Shenyang 110016, China; Key Laboratory of Intelligent Drug Design and New Drug Discovery of Liaoning Province, Shenyang Pharmaceutical University, Shenyang 110016, China; School of Medical Devices, Shenyang Pharmaceutical University, Shenyang 110016, China., Chen L; Key Laboratory of Structure-Based Drug Design & Discovery of Ministry of Education, Shenyang Pharmaceutical University, Shenyang 110016, China; Key Laboratory of Intelligent Drug Design and New Drug Discovery of Liaoning Province, Shenyang Pharmaceutical University, Shenyang 110016, China; School of Pharmaceutical Engineering, Shenyang Pharmaceutical University, Shenyang 110016, China., Liu H; Key Laboratory of Structure-Based Drug Design & Discovery of Ministry of Education, Shenyang Pharmaceutical University, Shenyang 110016, China; Key Laboratory of Intelligent Drug Design and New Drug Discovery of Liaoning Province, Shenyang Pharmaceutical University, Shenyang 110016, China; School of Pharmaceutical Engineering, Shenyang Pharmaceutical University, Shenyang 110016, China., Li W; Key Laboratory of Structure-Based Drug Design & Discovery of Ministry of Education, Shenyang Pharmaceutical University, Shenyang 110016, China; Key Laboratory of Intelligent Drug Design and New Drug Discovery of Liaoning Province, Shenyang Pharmaceutical University, Shenyang 110016, China; School of Pharmaceutical Engineering, Shenyang Pharmaceutical University, Shenyang 110016, China., Wang J; Key Laboratory of Structure-Based Drug Design & Discovery of Ministry of Education, Shenyang Pharmaceutical University, Shenyang 110016, China; Key Laboratory of Intelligent Drug Design and New Drug Discovery of Liaoning Province, Shenyang Pharmaceutical University, Shenyang 110016, China; School of Pharmaceutical Engineering, Shenyang Pharmaceutical University, Shenyang 110016, China. Electronic address: jianwang@syphu.edu.cn.

المصدر: Computational biology and chemistry [Comput Biol Chem] 2023 Jun; Vol. 104, pp. 107864. Date of Electronic Publication: 2023 Apr 05.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: Elsevier Country of Publication: England NLM ID: 101157394 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1476-928X (Electronic) Linking ISSN: 14769271 NLM ISO Abbreviation: Comput Biol Chem Subsets: MEDLINE

مواضيع طبية MeSH: Antitubercular Agents*/pharmacology , Antitubercular Agents*/chemistry , Quantitative Structure-Activity Relationship*, Molecular Docking Simulation ; Protein Binding ; Structure-Activity Relationship ; Binding Sites ; Molecular Dynamics Simulation

المؤلفون: Ninomiya Y; Department of Natural Environmental Studies, Graduate School of Frontier Sciences, The University of Tokyo, 5-1-5, Kashiwanoha, Kashiwa, Chiba 277-8563, Japan., Watanabe H; Department of Natural Environmental Studies, Graduate School of Frontier Sciences, The University of Tokyo, 5-1-5, Kashiwanoha, Kashiwa, Chiba 277-8563, Japan; Health and Environmental Risk Division, National Institute for Environmental Studies (NIES), 16-2 Onogawa, Tsukuba, Ibaraki 305-8506, Japan., Yamagishi T; Department of Natural Environmental Studies, Graduate School of Frontier Sciences, The University of Tokyo, 5-1-5, Kashiwanoha, Kashiwa, Chiba 277-8563, Japan; Health and Environmental Risk Division, National Institute for Environmental Studies (NIES), 16-2 Onogawa, Tsukuba, Ibaraki 305-8506, Japan., Maruyama-Komoda T; Division of Risk Assessment, Center for Biological and Safety Research, National Institute of Health Science (NIHS), 3-25-26, Tonomachi, Kawasaki-ku, Kawasaki, Kanagawa 210-9501, Japan., Yamada T; Division of Risk Assessment, Center for Biological and Safety Research, National Institute of Health Science (NIHS), 3-25-26, Tonomachi, Kawasaki-ku, Kawasaki, Kanagawa 210-9501, Japan., Yamamoto H; Department of Natural Environmental Studies, Graduate School of Frontier Sciences, The University of Tokyo, 5-1-5, Kashiwanoha, Kashiwa, Chiba 277-8563, Japan; Health and Environmental Risk Division, National Institute for Environmental Studies (NIES), 16-2 Onogawa, Tsukuba, Ibaraki 305-8506, Japan. Electronic address: yamamoto.hiroshi@nies.go.jp.

المصدر: Ecotoxicology and environmental safety [Ecotoxicol Environ Saf] 2024 Sep 01; Vol. 282, pp. 116737. Date of Electronic Publication: 2024 Jul 23.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: Elsevier Country of Publication: Netherlands NLM ID: 7805381 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1090-2414 (Electronic) Linking ISSN: 01476513 NLM ISO Abbreviation: Ecotoxicol Environ Saf Subsets: MEDLINE

مواضيع طبية MeSH: Daphnia*/drug effects , Quantitative Structure-Activity Relationship* , Water Pollutants, Chemical*/toxicity , Water Pollutants, Chemical*/chemistry, Animals ; Toxicity Tests, Chronic ; Pharmaceutical Preparations/chemistry ; Daphnia magna

المؤلفون: Dong W; College of Computer Science and Technology, Qingdao University, Qingdao, Shandong Province, China., Zhang P; College of Computer Science and Technology, Qingdao University, Qingdao, Shandong Province, China.

المصدر: Antimicrobial agents and chemotherapy [Antimicrob Agents Chemother] 2024 Jul 09; Vol. 68 (7), pp. e0026524. Date of Electronic Publication: 2024 May 29.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: American Society for Microbiology Country of Publication: United States NLM ID: 0315061 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1098-6596 (Electronic) Linking ISSN: 00664804 NLM ISO Abbreviation: Antimicrob Agents Chemother Subsets: MEDLINE

مواضيع طبية MeSH: Carbazoles*/pharmacology , Support Vector Machine* , Quantitative Structure-Activity Relationship*, Trypanocidal Agents/pharmacology

المؤلفون: Lv X; Hubei Key Laboratory of Petroleum Geochemistry and Environment (Yangtze University), Wuhan, 430100, China.; School of Resources and Environment, Yangtze University, Wuhan, 430100, China., He M; Hubei Key Laboratory of Petroleum Geochemistry and Environment (Yangtze University), Wuhan, 430100, China.; School of Resources and Environment, Yangtze University, Wuhan, 430100, China., Wei J; Hubei Key Laboratory of Petroleum Geochemistry and Environment (Yangtze University), Wuhan, 430100, China.; School of Resources and Environment, Yangtze University, Wuhan, 430100, China., Li Q; Hubei Key Laboratory of Petroleum Geochemistry and Environment (Yangtze University), Wuhan, 430100, China.; School of Resources and Environment, Yangtze University, Wuhan, 430100, China., Nie F; State Key Laboratory of Petroleum Pollution Control, CNPC Research Institute of Safety and Environmental Technology Co., Ltd, Beijing, 102206, China., Shao Z; State Key Laboratory of Petroleum Pollution Control, CNPC Research Institute of Safety and Environmental Technology Co., Ltd, Beijing, 102206, China., Wang Z; State Key Laboratory of Petroleum Pollution Control, CNPC Research Institute of Safety and Environmental Technology Co., Ltd, Beijing, 102206, China., Tian L; Hubei Key Laboratory of Petroleum Geochemistry and Environment (Yangtze University), Wuhan, 430100, China. tianlei4665@163.com.; School of Petroleum Engineering, Yangtze University, Wuhan, 430100, China. tianlei4665@163.com.

المصدر: Environmental science and pollution research international [Environ Sci Pollut Res Int] 2024 Jul; Vol. 31 (34), pp. 47220-47236. Date of Electronic Publication: 2024 Jul 11.

نوع المنشور: Journal Article

بيانات الدورية: Publisher: Springer Country of Publication: Germany NLM ID: 9441769 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1614-7499 (Electronic) Linking ISSN: 09441344 NLM ISO Abbreviation: Environ Sci Pollut Res Int Subsets: MEDLINE

مواضيع طبية MeSH: Quantitative Structure-Activity Relationship* , Hydrocarbons, Aromatic*/chemistry , Hydrocarbons, Aromatic*/toxicity, Risk Assessment