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Wyświetlanie 1-20 z 921092
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Tytuł :
Will the hype of automated drug discovery finally be realized?
Autorzy :
Cui W; Shenzhen Institute of Advanced Technology Chinese Academy of Sciences, Shenzhen, China.
Yuan S; Shenzhen Institute of Advanced Technology Chinese Academy of Sciences, Shenzhen, China.; Computational Drug Discovery, AlphaMol Science Ltd, Shenzhen, China.
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Źródło :
Expert opinion on drug discovery [Expert Opin Drug Discov] 2024 Mar; Vol. 19 (3), pp. 259-262. Date of Electronic Publication: 2023 Dec 11.
Typ publikacji :
Editorial
MeSH Terms :
Drug Discovery*
Artificial Intelligence*
Humans
Opinia redakcyjna
Szczegóły
Podgląd okładki
Tytuł :
This 'super gonorrhoea' drug holds a lesson for avoiding microbial armageddon.
Autorzy :
McKenna M
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Źródło :
Nature [Nature] 2024 Feb; Vol. 626 (8001), pp. 942-944.
Typ publikacji :
Wiadomości
MeSH Terms :
Anti-Bacterial Agents*/economics
Anti-Bacterial Agents*/pharmacology
Anti-Bacterial Agents*/supply & distribution
Organizations, Nonprofit*/economics
Drug Resistance, Microbial*/drug effects
Drug Costs*
Drug Discovery*/economics
Drug Discovery*/methods
Drug Discovery*/trends
Humans
Periodyk
Szczegóły
Podgląd okładki
Tytuł :
Stability-based approaches in chemoproteomics.
Autorzy :
George AL; Laboratory for Biomedical Mass Spectrometry, Biosciences Institute, Newcastle University, Newcastle-upon-Tyne, NE2 4HH, UK.
Dueñas ME; Laboratory for Biomedical Mass Spectrometry, Biosciences Institute, Newcastle University, Newcastle-upon-Tyne, NE2 4HH, UK.
Marín-Rubio JL; Laboratory for Biomedical Mass Spectrometry, Biosciences Institute, Newcastle University, Newcastle-upon-Tyne, NE2 4HH, UK.
Trost M; Laboratory for Biomedical Mass Spectrometry, Biosciences Institute, Newcastle University, Newcastle-upon-Tyne, NE2 4HH, UK.
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Źródło :
Expert reviews in molecular medicine [Expert Rev Mol Med] 2024 Apr 12; Vol. 26, pp. e6. Date of Electronic Publication: 2024 Apr 12.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Proteome*/analysis
Proteome*/chemistry
Proteome*/metabolism
Drug Discovery*/methods
Humans ; Mass Spectrometry ; Drug Development
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Autoimmune diseases: targets, biology, and drug discovery.
Autorzy :
Li SJ; State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, 201203, China. .; Department of Traditional Chinese Medicine, Fujian Medical University Union Hospital, Fuzhou, 350000, China. .
Wu YL; State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, 201203, China.
Chen JH; State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, 201203, China.
Shen SY; State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, 201203, China.; University of Chinese Academy of Sciences, Beijing, 100049, China.
Duan J; State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, 201203, China. .; University of Chinese Academy of Sciences, Beijing, 100049, China. .; Zhongshan Institute for Drug Discovery, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Zhongshan, 528400, China. .
Xu HE; State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Chinese Academy of Sciences, Shanghai, 201203, China. .; School of Life Science and Technology, Shanghai Tech University, Shanghai, 201210, China. .
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Źródło :
Acta pharmacologica Sinica [Acta Pharmacol Sin] 2024 Apr; Vol. 45 (4), pp. 674-685. Date of Electronic Publication: 2023 Dec 14.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Autoantigens*/immunology
Autoimmune Diseases*/drug therapy
Autoimmune Diseases*/immunology
Diabetes Mellitus, Type 1*/drug therapy
Diabetes Mellitus, Type 1*/immunology
Drug Discovery*
Insulin*/immunology
Humans
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
A bidirectional interpretable compound-protein interaction prediction framework based on cross attention.
Autorzy :
Wang M; School of Public Health, Harbin Medical University, Harbin, 150081, China.
Wang J; School of Integrative Biotechnology and Translational Medicine, Yonsei University, Incheon, 21983, Republic of Korea.
Rong Z; School of Public Health, Peking University, Beijing, 100871, China.
Wang L; School of Public Health, Harbin Medical University, Harbin, 150081, China.
Xu Z; School of Public Health, Harbin Medical University, Harbin, 150081, China.
Zhang L; School of Public Health, Harbin Medical University, Harbin, 150081, China.
He J; School of Public Health, Harbin Medical University, Harbin, 150081, China.
Li S; School of Public Health, Harbin Medical University, Harbin, 150081, China.
Cao L; School of Public Health, Harbin Medical University, Harbin, 150081, China.
Hou Y; School of Public Health, Peking University, Beijing, 100871, China.
Li K; School of Public Health, Harbin Medical University, Harbin, 150081, China. Electronic address: .
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Źródło :
Computers in biology and medicine [Comput Biol Med] 2024 Apr; Vol. 172, pp. 108239. Date of Electronic Publication: 2024 Mar 02.
Typ publikacji :
Journal Article
MeSH Terms :
Drug Discovery*
Labor, Obstetric*
Pregnancy ; Female ; Humans ; Amino Acid Sequence ; Cluster Analysis ; Neural Networks, Computer
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Molecular hybridization: a powerful tool for multitarget drug discovery.
Autorzy :
de Sena Murteira Pinheiro P; Laboratório de Avaliação e Síntese de Substâncias Bioativas (LASSBio), Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.
Franco LS; Laboratório de Avaliação e Síntese de Substâncias Bioativas (LASSBio), Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.; Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.
Montagnoli TL; Laboratório de Avaliação e Síntese de Substâncias Bioativas (LASSBio), Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.; Programa de Pós-Graduação em Farmacologia e Química Medicinal, Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.
Fraga CAM; Laboratório de Avaliação e Síntese de Substâncias Bioativas (LASSBio), Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.; Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.; Programa de Pós-Graduação em Farmacologia e Química Medicinal, Instituto de Ciências Biomédicas, Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil.
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Źródło :
Expert opinion on drug discovery [Expert Opin Drug Discov] 2024 Apr; Vol. 19 (4), pp. 451-470. Date of Electronic Publication: 2024 Mar 08.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Drug Discovery*
Alzheimer Disease*/drug therapy
Alzheimer Disease*/genetics
Humans ; Polypharmacology ; Drug Design
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
A domain-label-guided translation model for molecular optimization.
Autorzy :
Zhang Y; School of Computer Science and Technology, Anhui University, Hefei, 230601, China. Electronic address: .
Tong Y; School of Computer Science and Technology, Anhui University, Hefei, 230601, China. Electronic address: .
Xia X; Institute of Artificial Intelligence, Hefei Comprehensive National Science Center, Hefei, 230088, China; School of Artificial Intelligence, Anhui University, Hefei, 230601, China. Electronic address: .
Wu Q; Affiliated Hospital of Jining Medical University, Jining, 272007, China. Electronic address: .
Su Y; Institute of Artificial Intelligence, Hefei Comprehensive National Science Center, Hefei, 230088, China; School of Artificial Intelligence, Anhui University, Hefei, 230601, China. Electronic address: .
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Źródło :
Methods (San Diego, Calif.) [Methods] 2024 Apr; Vol. 224, pp. 71-78. Date of Electronic Publication: 2024 Feb 21.
Typ publikacji :
Journal Article
MeSH Terms :
Drug Discovery*
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Piquing artificial intelligence towards drug discovery: Tools, techniques, and applications.
Autorzy :
Agu PC; Department of Biochemistry, College of Science, Evangel University, Akaeze, Ebonyi State, Nigeria.
Obulose CN; Department of Computer Sciences, Our Savior Institute of Science, Agriculture, and Technology (OSISATECH Polytechnic), Enugu, Nigeria.
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Źródło :
Drug development research [Drug Dev Res] 2024 Apr; Vol. 85 (2), pp. e22159.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Artificial Intelligence*
Drug Discovery*
Drug Development ; Drug Design ; Drug Delivery Systems
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
BioPrint meets the AI age: development of artificial intelligence-based ADMET models for the drug-discovery platform SAFIRE.
Autorzy :
Biehn SE; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
Goncalves LM; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
Lehmann J; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
Marty JD; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
Mueller C; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
Ramirez SA; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
Tillier F; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
Sage CR; Eurofins DiscoveryAI, Eurofins Panlabs, Inc., Saint Charles, MO 63304, USA.
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Źródło :
Future medicinal chemistry [Future Med Chem] 2024 Apr; Vol. 16 (7), pp. 587-599. Date of Electronic Publication: 2024 Feb 19.
Typ publikacji :
Journal Article
MeSH Terms :
Artificial Intelligence*
Drug Discovery*
Databases, Factual
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Academic drug discovery: Challenges and opportunities.
Autorzy :
Murray AJ; Birmingham Drug Discovery Hub, College of Medical and Dental Sciences, University of Birmingham, Birmingham, UK.
Cox LR; School of Chemistry, University of Birmingham, Birmingham, UK.
Adcock HV; Birmingham Drug Discovery Hub, College of Medical and Dental Sciences, University of Birmingham, Birmingham, UK.
Roberts RA; Birmingham Drug Discovery Hub, College of Medical and Dental Sciences, University of Birmingham, Birmingham, UK; School of Biosciences, University of Birmingham, Birmingham, UK; ApconiX, Alderley Park, Macclesfield, UK. Electronic address: .
Pokaż więcej
Źródło :
Drug discovery today [Drug Discov Today] 2024 Apr; Vol. 29 (4), pp. 103918. Date of Electronic Publication: 2024 Feb 14.
Typ publikacji :
Journal Article
MeSH Terms :
Drug Discovery*
Drug Industry*
Universities ; Investments
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
The role of NMR in advancing small molecule drug discovery.
Autorzy :
Poppe L; 3843 Timberridge Rd, Moorpark, CA 93021, USA. Electronic address: .
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Źródło :
Trends in pharmacological sciences [Trends Pharmacol Sci] 2024 Apr; Vol. 45 (4), pp. 283-286. Date of Electronic Publication: 2024 Feb 13.
Typ publikacji :
Journal Article
MeSH Terms :
Proteins*/chemistry
Drug Discovery*
Humans ; Magnetic Resonance Spectroscopy ; Ligands
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Cryosphere: a frozen home of microbes and a potential source for drug discovery.
Autorzy :
Zada S; Guangzhou Institute of Energy Conversion, Chinese Academy of Sciences, Guangzhou, China.
Khan M; Department of Biological Sciences, Ohio University Athens, Athens, OH, USA.
Su Z; Guangzhou Institute of Energy Conversion, Chinese Academy of Sciences, Guangzhou, China.
Sajjad W; State Key Laboratory of Cryospheric Science, Northwest Institute of Eco-Environment and Resources, Chinese Academy of Sciences, Lanzhou, 730000, China. .
Rafiq M; Department of Microbiology, Faculty of Life Sciences and Informatics, Balochistan University of IT, Engineering and Management Sciences, Quetta, 87650, Pakistan. .
Pokaż więcej
Źródło :
Archives of microbiology [Arch Microbiol] 2024 Mar 28; Vol. 206 (4), pp. 196. Date of Electronic Publication: 2024 Mar 28.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Drug Discovery*
Biological Products*/pharmacology
Bioprospecting
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Targeting autophagy drug discovery: Targets, indications and development trends.
Autorzy :
Jiang M; Department of Pharmacology and Pharmacy, China Jiliang University, China.
Wu W; College of Osteopathic Medicine, New York Institute of Technology, USA.
Xiong Z; Department of Pharmacology and Pharmacy, China Jiliang University, China.
Yu X; Department of Biology, China Jiliang University, China.
Ye Z; Department of Biology, China Jiliang University, China.
Wu Z; Department of Pharmacology and Pharmacy, China Jiliang University, China. Electronic address: .
Pokaż więcej
Źródło :
European journal of medicinal chemistry [Eur J Med Chem] 2024 Mar 05; Vol. 267, pp. 116117. Date of Electronic Publication: 2024 Jan 23.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Drug Discovery*
Neoplasms*/metabolism
Humans ; Autophagy ; Drug Design ; Signal Transduction
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Recent advances in generative biology for biotherapeutic discovery.
Autorzy :
Mock M; Amgen Research, Amgen Inc., One Amgen Center Drive, Thousand Oaks, CA 91320, USA.
Langmead CJ; Amgen Research, Amgen Inc., One Amgen Center Drive, Thousand Oaks, CA 91320, USA.
Grandsard P; Amgen Research, Amgen Inc., One Amgen Center Drive, Thousand Oaks, CA 91320, USA.
Edavettal S; Amgen Research, Amgen Inc., One Amgen Center Drive, Thousand Oaks, CA 91320, USA.
Russell A; Amgen Research, Amgen Inc., One Amgen Center Drive, Thousand Oaks, CA 91320, USA. Electronic address: .
Pokaż więcej
Źródło :
Trends in pharmacological sciences [Trends Pharmacol Sci] 2024 Mar; Vol. 45 (3), pp. 255-267. Date of Electronic Publication: 2024 Feb 19.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Artificial Intelligence*
Drug Discovery*/methods
Humans ; Biology
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Recent advances in multitarget-directed ligands via in silico drug discovery.
Autorzy :
Maddeboina K; Molecular Targeted Therapeutics Laboratory, Levine Cancer Institute/Atrium Health, Charlotte, NC 28204, USA; Department of Biochemistry, Atrium Health Wake Forest Baptist Comprehensive Cancer Center, Wake Forest University School of Medicine, Winston Salem, NC 27157, USA. Electronic address: .
Yada B; Molecular Targeted Therapeutics Laboratory, Levine Cancer Institute/Atrium Health, Charlotte, NC 28204, USA.
Kumari S; Department of Chemistry, Yale University, 225 Prospect Street, New Haven, CT 06520, USA.
McHale C; Molecular Targeted Therapeutics Laboratory, Levine Cancer Institute/Atrium Health, Charlotte, NC 28204, USA.
Pal D; Molecular Targeted Therapeutics Laboratory, Levine Cancer Institute/Atrium Health, Charlotte, NC 28204, USA.
Durden DL; Molecular Targeted Therapeutics Laboratory, Levine Cancer Institute/Atrium Health, Charlotte, NC 28204, USA; Department of Biochemistry, Atrium Health Wake Forest Baptist Comprehensive Cancer Center, Wake Forest University School of Medicine, Winston Salem, NC 27157, USA. Electronic address: .
Pokaż więcej
Źródło :
Drug discovery today [Drug Discov Today] 2024 Mar; Vol. 29 (3), pp. 103904. Date of Electronic Publication: 2024 Jan 26.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Drug Discovery*
Polypharmacology*
Structure-Activity Relationship ; Pharmaceutical Preparations ; Ligands ; Drug Design
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
The European Lead Factory: Results from a decade of collaborative, public-private, drug discovery programs.
Autorzy :
van Vlijmen H; Janssen Research & Development, Turnhoutseweg 30, 2340 Beerse, Belgium. Electronic address: .
Pannifer AD; Biocity Scotland, Bo'ness Road, Newhouse ML1 5SH, UK.
Cochrane P; Unit 8, Dock Offices Surrey Quays Rd, SE16 2XU, UK.
Basting D; Bayer AG, Aprather Weg 18a, 42113 Wuppertal, Germany.
Li VM; Bayer AG, Aprather Weg 18a, 42113 Wuppertal, Germany.
Engkvist O; AstraZeneca Discovery Sciences, Pepparedsleden 1, SE-431 83 Mölndal, Sweden.
Ortholand JY; Edelris, 60, Avenue Rockefeller, F-69008 Lyon, France.
Wagener M; Grünenthal, 52099 Aachen, Germany.
Duffy J; Medicines for Malaria Venture, ICC 20, Rte de Pré-Bois, 1215 Geneva, Switzerland.
Finsinger D; Merck KGaA, Frankfurter Str. 250, 64293 Darmstadt, Germany.
Davis J; UCB Biopharma UK, 216 Bath Road, Slough, SL1 3WE, UK.
van Helden SP; Pivot Park Screening Centre, Kloosterstraat 9, 5349 AB Oss, the Netherlands.
de Vlieger JSB; Lygature, Jaarbeursplein 6, 3521 AL Utrecht, the Netherlands.
Pokaż więcej
Corporate Authors :
European Lead Factory Consortium
Źródło :
Drug discovery today [Drug Discov Today] 2024 Mar; Vol. 29 (3), pp. 103886. Date of Electronic Publication: 2024 Jan 18.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Small Molecule Libraries*/chemistry
Drug Discovery*/methods
High-Throughput Screening Assays/methods ; Drug Industry ; Universities
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Have spirocyclic scaffolds been properly utilized in recent drug discovery efforts?
Autorzy :
Benedetti E
Micouin L; Laboratoire de Chimie et Biochimie Pharmacologiques et Toxicologiques, Université Paris Cité, CNRS, Paris, France.
Pokaż więcej
Źródło :
Expert opinion on drug discovery [Expert Opin Drug Discov] 2024 Mar; Vol. 19 (3), pp. 263-266. Date of Electronic Publication: 2024 Jan 18.
Typ publikacji :
Editorial
MeSH Terms :
Drug Discovery*
Drug Design*
Humans
Opinia redakcyjna
Szczegóły
Podgląd okładki
Tytuł :
Fragment databases from screened ligands for drug discovery (FDSL-DD).
Autorzy :
Wilson J; Department of Chemistry, Drexel University, Philadelphia, PA, 19104, USA.
Sokhansanj BA; Ecological and Evolutionary Signal-processing and Informatics Lab, Department of Electrical and Computer Engineering, Drexel University, Philadelphia, PA, 19104, USA.
Chong WC; Ecological and Evolutionary Signal-processing and Informatics Lab, Department of Electrical and Computer Engineering, Drexel University, Philadelphia, PA, 19104, USA.
Chandraghatgi R; Ecological and Evolutionary Signal-processing and Informatics Lab, Department of Electrical and Computer Engineering, Drexel University, Philadelphia, PA, 19104, USA.
Rosen GL; Ecological and Evolutionary Signal-processing and Informatics Lab, Department of Electrical and Computer Engineering, Drexel University, Philadelphia, PA, 19104, USA. Electronic address: .
Ji HF; Department of Chemistry, Drexel University, Philadelphia, PA, 19104, USA. Electronic address: .
Pokaż więcej
Źródło :
Journal of molecular graphics & modelling [J Mol Graph Model] 2024 Mar; Vol. 127, pp. 108669. Date of Electronic Publication: 2023 Nov 22.
Typ publikacji :
Journal Article; Research Support, U.S. Gov't, Non-P.H.S.; Research Support, Non-U.S. Gov't
MeSH Terms :
Drug Discovery*/methods
Drug Design*
Ligands ; High-Throughput Screening Assays ; Databases, Factual
Czasopismo naukowe
Szczegóły
Podgląd okładki
Tytuł :
Ultra-high-throughput mass spectrometry in drug discovery: fundamentals and recent advances.
Autorzy :
Williams JD; Abbvie Discovery Research, North Chicago, IL, USA.
Pu F; Abbvie Discovery Research, North Chicago, IL, USA.
Sawicki JW; Abbvie Discovery Research, North Chicago, IL, USA.
Elsen NL; Abbvie Discovery Research, North Chicago, IL, USA.
Pokaż więcej
Źródło :
Expert opinion on drug discovery [Expert Opin Drug Discov] 2024 Mar; Vol. 19 (3), pp. 291-301. Date of Electronic Publication: 2023 Dec 19.
Typ publikacji :
Journal Article; Review
MeSH Terms :
Drug Discovery*/methods
Liquid Chromatography-Mass Spectrometry*
Humans ; Mass Spectrometry/methods
Czasopismo naukowe
Szczegóły
Wyświetlanie 1-20 z 921092

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