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1.
1494 Accesses
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Transformation of PVP coated silver nanoparticles in a simulated wastewater treatment process and the effect on microbial communities
Casey L Doolette, Mike J McLaughlin, Jason K Kirby, Damien J Batstone, Hugh H Harris, Huoqing Ge, Geert Cornelis Chemistry Central Journal 2013, 7:46 (4 March 2013)
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The fate of AgNPs, which are increasingly found in consumer products and therefore wastewater, was investigated in sewage subjected to aerobic and anaerobic treatment, and the impact of AgNPs on microbial processes and communities was evaluated.
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2.
1454 Accesses
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Extracting and connecting chemical structures from text sources using chemicalize.org
Christopher Southan, Andras Stracz Journal of Cheminformatics 2013, 5:20 (23 April 2013)
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This work demonstrates the utility of chemicalize.org for the exploration of chemical structure connectivity between documents and databases, including structure searches in PubChem, InChIKey searches in Google and the chemicalize.org archive
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3.
1419 Accesses
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The ChEMBL database as linked open data
Egon L Willighagen, Andra Waagmeester, Ola Spjuth, Peter Ansell, Antony J Williams, Valery Tkachenko, Janna Hastings, Bin Chen, David J Wild Journal of Cheminformatics 2013, 5:23 (8 May 2013)
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An ongoing project converting data from the ChEMBL database into RDF triples. The ChEMBL-RDF resource creates a foundation for integrated semantic web cheminformatics applications.
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4.
1370 Accesses
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JSME: a free molecule editor in JavaScript
Bruno Bienfait, Peter Ertl Journal of Cheminformatics 2013, 5:24 (21 May 2013)
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A free molecule editor written in JavaScript was developed and is released under the terms of permissive BSD license. The editor is compatible with JME, has practically the same user interface as well as the web application programming interface.
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5.
1364 Accesses
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Partitioning of silver and chemical speciation of free Ag in soils amended with nanoparticles
Rachel Benoit, Kevin J Wilkinson, Sébastien Sauvé Chemistry Central Journal 2013, 7:75 (25 April 2013)
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Speciation results are acquired using a silver ion selective electrode in 3 soils. The study differentiates free silver ions from silver in the <0.45 µm fraction in soil solution and helps us understand how nanosilver reacts in soils.
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6.
1353 Accesses
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Metabolic fingerprinting of Angelica sinensis during growth using UPLC-TOFMS and chemometrics data analysis
Yiyun Qian, Yali Wang, Rina Sa, Hui Yan, Xinbo Pan, Yingwen Yang, Yujing Sun Chemistry Central Journal 2013, 7:42 (1 March 2013)
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7.
1173 Accesses
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Evaluation of Biologically Active Compounds from Calendula officinalis Flowers using Spectrophotometry
Monica Butnariu, Cristina Coradini Chemistry Central Journal 2012, 6:35 (27 April 2012)
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8.
1169 Accesses
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Avogadro: an advanced semantic chemical editor, visualization, and analysis platform
Marcus D Hanwell, Donald E Curtis, David C Lonie, Tim Vandermeersch, Eva Zurek, Geoffrey R Hutchison Journal of Cheminformatics 2012, 4:17 (13 August 2012)
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The Avogadro project has developed an advanced molecule editor and visualizer designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
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9.
1127 Accesses
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Comparison of antioxidant activity and flavanol content of cacao beans processed by modern and traditional Mesoamerican methods
Elizabeth Chin, Kenneth B Miller, Mark J Payne, W Jeffery Hurst, David A Stuart Heritage Science 2013, 1:9 (5 April 2013)
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10.
1097 Accesses
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Carnosine: can understanding its actions on energy metabolism and protein homeostasis inform its therapeutic potential?
Alan R Hipkiss, Stephanie P Cartwright, Clare Bromley, Stephane R Gross, Roslyn M Bill Chemistry Central Journal 2013, 7:38 (25 February 2013)
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Carnosine, a compound found in meat, has a range of beneficial properties, and may aid in the treatment of Alzheimer’s, Parkinson’s and other age-related diseases. This review discusses the mechanisms that could accommodate the uniquely disparate effects of carnosine on cellular activity
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11.
1087 Accesses
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Linked open drug data for pharmaceutical research and development
Matthias Samwald, Anja Jentzsch, Christopher Bouton, Claus Kallesøe, Egon Willighagen, Janos Hajagos, M Marshall, Eric Prud'hommeaux, Oktie Hassanzadeh, Elgar Pichler, Susie Stephens Journal of Cheminformatics 2011, 3:19 (16 May 2011)
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12.
1081 Accesses
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A critical study on efficiency of different materials for fluoride removal from aqueous media
Vaishali Tomar, Dinesh Kumar Chemistry Central Journal 2013, 7:51 (13 March 2013)
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Fluoride is a persistent and non-biodegradable pollutant that accumulates in soil, plants, wildlife and in human beings. This review surveys the efficacy of different materials for the removal of fluoride from water
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13.
1065 Accesses
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Chemical consequences of cutaneous photoageing
Sarah A Thurstan, Neil K Gibbs, Abigail K Langton, Christopher EM Griffiths, Rachel EB Watson, Michael J Sherratt Chemistry Central Journal 2012, 6:34 (25 April 2012)
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UV radiation exacerbates the intrinsic ageing of human skin, accelerating the onset of age-related changes, such as wrinkle formation. This review discusses experimental evidence for UV-mediated differential degradation of normally long lived dermal proteins
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14.
1060 Accesses
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Toward a general theory of evolution: Extending Darwinian theory to inanimate matter
Addy Pross Journal of Systems Chemistry 2011, 2:1 (7 June 2011)
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15.
963 Accesses
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The effects of hydration on the collagen and gelatine phases within parchment artefacts
Lee Grant Gonzalez, Timothy James Wess Heritage Science 2013, 1:14 (24 April 2013)
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This review discusses the need to understand the effects of relative humidity on parchment and the current understanding of parchment structure and hydration. It also provides a critical evaluation of the body of foregoing research investigating the effects of relative humidity on parchment artefacts.
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16.
965 Accesses
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Cacao seeds are a "Super Fruit": A comparative analysis of various fruit powders and products
Stephen J Crozier, Amy G Preston, Jeffrey W Hurst, Mark J Payne, Julie Mann, Larry Hainly, Debra L Miller Chemistry Central Journal 2011, 5:5 (7 February 2011)
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17.
907 Accesses
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Preparation and magnetic properties of nano size nickel ferrite particles using hydrothermal method
Kamellia Nejati, Rezvanh Zabihi Chemistry Central Journal 2012, 6:23 (30 March 2012)
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18.
889 Accesses
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Druggable chemical space and enumerative combinatorics
Melvin J Yu Journal of Cheminformatics 2013, 5:19 (18 April 2013)
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19.
849 Accesses
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TiO2-graphene oxide nanocomposite as advanced photocatalytic materials
Václav Štengl, Snejana Bakardjieva, Tomáš Matys Grygar, Jana Bludská, Martin Kormunda Chemistry Central Journal 2013, 7:41 (27 February 2013)
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20.
853 Accesses
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Synthesis and characterization of ZnO nanostructures using palm olein as biotemplate
Donya Ramimoghadam, Mohd Zobir Bin Hussein, Yun Hin Taufiq-Yap Chemistry Central Journal 2013, 7:71 (20 April 2013)
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21.
833 Accesses
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Limit of detection and limit of quantification development procedures for organochlorine pesticides analysis in water and sediment matrices
Naghmeh Saadati, Md Pauzi Abdullah, Zuriati Zakaria, Seyedeh Belin Tavakoli Sany, Majid Rezayi, Houshang Hassonizadeh Chemistry Central Journal 2013, 7:63 (5 April 2013)
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22.
832 Accesses
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Study on the stability and antioxidant effect of the Allium ursinum watery extract
Salomeia Putnoky, Angela Caunii, Monica Butnariu Chemistry Central Journal 2013, 7:21 (1 February 2013)
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23.
827 Accesses
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Heavy metals health risk assessment for population via consumption of vegetables grown in old mining area; a case study: Banat County, Romania
Monica Harmanescu, Liana Alda, Despina Bordean, Ioan Gogoasa, Iosif Gergen Chemistry Central Journal 2011, 5:64 (22 October 2011)
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24.
823 Accesses
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Reverse phase chromatographic behaviour of major components in Capsicum Annuum extract
Monica Butnariu, Angela Caunii, Salomeia Putnoky Chemistry Central Journal 2012, 6:146 (4 December 2012)
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25.
820 Accesses
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A tandem regression-outlier analysis of a ligand cellular system for key structural modifications around ligand binding
Ying-Ting Lin Journal of Cheminformatics 2013, 5:21 (30 April 2013)
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26.
817 Accesses
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An analysis of Sorghum halepense’s behavior in presence of tropane alkaloids from Datura stramonium extracts
Monica Butnariu Chemistry Central Journal 2012, 6:75 (28 July 2012)
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27.
800 Accesses
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Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions
Peter Ertl, Ansgar Schuffenhauer Journal of Cheminformatics 2009, 1:8 (10 June 2009)
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28.
796 Accesses
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Synthesis, insecticidal, and antibacterial activities of novel neonicotinoid analogs with dihydropyridine
Yinju He, Deyu Hu, Mingming Lv, Linhong Jin, Jian Wu, Song Zeng, Song Yang, Baoan Song Chemistry Central Journal 2013, 7:76 (26 April 2013)
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29.
782 Accesses
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The influence of the inactives subset generation on the performance of machine learning methods
Sabina Smusz, Rafał Kurczab, Andrzej J Bojarski Journal of Cheminformatics 2013, 5:17 (5 April 2013)
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30.
780 Accesses
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Characterization of casein hydrolysates derived from enzymatic hydrolysis
Jinshui Wang, Yinjie Su, Feng Jia, Huali Jin Chemistry Central Journal 2013, 7:62 (4 April 2013)
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31.
758 Accesses
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Open Babel: An open chemical toolbox
Noel M O'Boyle, Michael Banck, Craig A James, Chris Morley, Tim Vandermeersch, Geoffrey R Hutchison Journal of Cheminformatics 2011, 3:33 (7 October 2011)
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The first publication reporting the features, implementation and validation of the open source chemical toolbox - Open Babel - is described, which includes a summary of key advances in the 2.3 release
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32.
756 Accesses
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The surface properties of Shewanella putrefaciens 200 and S. oneidensis MR-1: the effect of pH and terminal electron acceptors
Yoko Furukawa, Jason R Dale Geochemical Transactions 2013, 14:3 (8 April 2013)
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33.
752 Accesses
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Design of optimal solvent for extraction of bio–active ingredients from six varieties of Medicago sativa
Angela Caunii, George Pribac, Ioana Grozea, Dorin Gaitin, Ionel Samfira Chemistry Central Journal 2012, 6:123 (26 October 2012)
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34.
751 Accesses
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Synthesis and antifungal activities of novel nicotinamide derivatives containing 1,3,4-oxadiazole
Jian Wu, Shenghong Kang, Lijun Luo, Qingcai Shi, Juan Ma, Juan Yin, Baoan Song, Deyu Hu, Song Yang Chemistry Central Journal 2013, 7:64 (5 April 2013)
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35.
744 Accesses
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Fine particulate matter in indoor cultural heritage: a literature review
Josep Grau-Bové, Matija Strlič Heritage Science 2013, 1:8 (3 April 2013)
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36.
737 Accesses
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Non-invasive analytical techniques applied to characterize the components of ancient golden medallions
Jose L Perez-Rodriguez, María D Robador, María C Jimenez de Haro, Jose M Martinez Blanes, Isabel Garofano, Carlos Odriozola, Adrian Duran Heritage Science 2013, 1:4 (3 April 2013)
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37.
735 Accesses
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Chemo-sensors development based on low-dimensional codoped Mn2O3-ZnO nanoparticles using flat-silver electrodes
Mohammed M Rahman, George Gruner, Mohammed Saad Al-Ghamdi, Muhammed A Daous, Sher Bahadar Khan, Abdullah M Asiri Chemistry Central Journal 2013, 7:60 (28 March 2013)
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38.
729 Accesses
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Calcium hydroxide nanosols for the consolidation of porous building materials - results from EU-STONECORE
Arnulf Daehne, Christoph Herm Heritage Science 2013, 1:11 (9 April 2013)
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39.
728 Accesses
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Multi-analyte approach for determining the extraction of tobacco constituents from pouched snus by consumers during use
Helena Digard, Nathan Gale, Graham Errington, Nicola Peters, Kevin McAdam Chemistry Central Journal 2013, 7:55 (2 April 2013)
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40.
713 Accesses
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Classification of Hungarian medieval silver coins using x-ray fluorescent spectroscopy and multivariate data analysis
Anita Rácz, Károly Héberger, Róbert Rajkó, János Elek Heritage Science 2013, 1:2 (3 April 2013)
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41.
704 Accesses
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On the propagation of a conceptual error concerning hypercycles and cooperation
Eörs Szathmáry Journal of Systems Chemistry 2013, 4:1 (11 February 2013)
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42.
702 Accesses
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Use of enzymatic tools for biomonitoring inorganic pollution in aquatic sediments: a case study (Bor, Serbia)
Marioara Nicoleta Filimon, Dragos V Nica, Vasile Ostafe, Despina-Maria Bordean, Aurica Breica Borozan, Daliborca Cristina Vlad, Roxana Popescu Chemistry Central Journal 2013, 7:59 (28 March 2013)
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43.
697 Accesses
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Recovery and examination of sculpture group Fugitive Slave by V. Beklemishev
Kamilla B Kalinina, Sander Habets, Evelina A Tarasova, Svetlana L Petrova Heritage Science 2013, 1:5 (3 April 2013)
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44.
680 Accesses
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Influence of emulsifiers on the characteristics of polyurethane structures used as drug carrier
Alina Heghes, Codruta M Soica, Simona Ardelean, Rita Ambrus, Danina Muntean, Atena Galuscan, Dan Dragos, Daniela Ionescu, Florin Borcan Chemistry Central Journal 2013, 7:66 (10 April 2013)
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45.
672 Accesses
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Microbial transformation of anti-cancer steroid exemestane and cytotoxicity of its metabolites against cancer cell lines
Elias Baydoun, Marium Bibi, Muhammad Asif Iqbal, Atia-tul Wahab, Dina Farran, Colon Smith, Samina A Sattar, Atta-ur Rahman, M Iqbal Choudhary Chemistry Central Journal 2013, 7:57 (27 March 2013)
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46.
653 Accesses
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Electrochemical DNA biosensor based on the BDD nanograss array electrode
Huali Jin, Min Wei, Jinshui Wang Chemistry Central Journal 2013, 7:65 (10 April 2013)
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47.
647 Accesses
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Analytical pyrolysis with in-situ silylation, Py(HMDS)-GC/MS, for the chemical characterization of archaeological and historical amber objects
Maria Perla Colombini, Erika Ribechini, Marco Rocchi, Paola Selleri Heritage Science 2013, 1:6 (3 April 2013)
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48.
645 Accesses
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Determination of the content of rosmarinic acid by HPLC and analytical comparison of volatile constituents by GC-MS in different parts of Perilla frutescens (L.) Britt
Jing Liu, Yuklam Wan, Zhongzhen Zhao, Hubiao Chen Chemistry Central Journal 2013, 7:61 (1 April 2013)
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49.
633 Accesses
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Alkaline decomposition of synthetic jarosite with arsenic
Francisco Patiño, Mizraim U Flores, Iván A Reyes, Martín Reyes, Juan Hernández, Isauro Rivera, Julio C Juárez Geochemical Transactions 2013, 14:2 (8 April 2013)
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50.
623 Accesses
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Temporal humidity variations in the heritage climate of South East England
Peter Brimblecombe Heritage Science 2013, 1:3 (3 April 2013)
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