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1.
45591 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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2.
10912 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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3.
8297 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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4.
6806 Accesses
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Different extraction methods of biologically active components from propolis: a preliminary study
Boryana Trusheva, Dorina Trunkova, Vassya Bankova Chemistry Central Journal 2007, 1:13 (7 June 2007)
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5.
5638 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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6.
4776 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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7.
4604 Accesses
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Chemistry in Second Life
Andrew SID Lang, Jean-Claude Bradley Chemistry Central Journal 2009, 3:14 (23 October 2009)
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8.
4476 Accesses
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Effect of carboxymethyl cellulose concentration on physical properties of biodegradable cassava starch-based films
Wirongrong Tongdeesoontorn, Lisa J Mauer, Sasitorn Wongruong, Pensiri Sriburi, Pornchai Rachtanapun Chemistry Central Journal 2011, 5:6 (10 February 2011)
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9.
4420 Accesses
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Molecular structure input on the web
Peter Ertl Journal of Cheminformatics 2010, 2:1 (2 February 2010)
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10.
4313 Accesses
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Chemical analysis of Greek pollen - Antioxidant, antimicrobial and proteasome activation properties
Konstantia Graikou, Suzanne Kapeta, Nektarios Aligiannis, George Sotiroudis, Niki Chondrogianni, Efstathios Gonos, Ioanna Chinou Chemistry Central Journal 2011, 5:33 (23 June 2011)
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11.
4100 Accesses
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Openness as infrastructure
John Wilbanks Journal of Cheminformatics 2011, 3:36 (14 October 2011)
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12.
4025 Accesses
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Computer-assisted methods for molecular structure elucidation: realizing a spectroscopist's dream
Mikhail Elyashberg, Kirill Blinov, Sergey Molodtsov, Yegor Smurnyy, Antony J Williams, Tatiana Churanova Journal of Cheminformatics 2009, 1:3 (17 March 2009)
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13.
4007 Accesses
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ChemicalTagger: A tool for semantic text-mining in chemistry
Lezan Hawizy, David M Jessop, Nico Adams, Peter Murray-Rust Journal of Cheminformatics 2011, 3:17 (16 May 2011)
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14.
3983 Accesses
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Welcome Home, Systems Chemists!
Günter von Kiedrowski, Sijbren Otto, Piet Herdewijn Journal of Systems Chemistry 2010, 1:1 (18 August 2010)
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15.
3944 Accesses
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Antioxidant activity relationship of phenolic compounds in Hypericum perforatum L.
Dejan Z Orčić, Neda M Mimica-Dukić, Marina M Francišković, Slobodan S Petrović, Emilija Đ Jovin Chemistry Central Journal 2011, 5:34 (25 June 2011)
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16.
3922 Accesses
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Virtual screening of bioassay data
Amanda C Schierz Journal of Cheminformatics 2009, 1:21 (22 December 2009)
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17.
3901 Accesses
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MOLA: a bootable, self-configuring system for virtual screening using AutoDock4/Vina on computer clusters
Rui MV Abreu, Hugo JC Froufe, Maria Queiroz, Isabel CFR Ferreira Journal of Cheminformatics 2010, 2:10 (28 October 2010)
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18.
3884 Accesses
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Analysis of in vitro bioactivity data extracted from drug discovery literature and patents: Ranking 1654 human protein targets by assayed compounds and molecular scaffolds
Christopher Southan, Kiran Boppana, Sarma ARP Jagarlapudi, Sorel Muresan Journal of Cheminformatics 2011, 3:14 (13 May 2011)
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19.
3716 Accesses
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Analytical methods applied to diverse types of Brazilian propolis
Alexandra Sawaya, Ildenize Barbosa da Silva Cunha, Maria Marcucci Chemistry Central Journal 2011, 5:27 (1 June 2011)
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20.
3689 Accesses
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Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on
Noel M O'Boyle, Rajarshi Guha, Egon L Willighagen, Samuel E Adams, Jonathan Alvarsson, Jean-Claude Bradley, Igor V Filippov, Robert M Hanson, Marcus D Hanwell, Geoffrey R Hutchison, Craig A James, Nina Jeliazkova, Andrew SID Lang, Karol M Langner, David C Lonie, Daniel M Lowe, Jérôme Pansanel, Dmitry Pavlov, Ola Spjuth, Christoph Steinbeck, Adam L Tenderholt, Kevin J Theisen, Peter Murray-Rust Journal of Cheminformatics 2011, 3:37 (14 October 2011)
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The work carried out by the Blue Obelisk movement over the last five years is described, with a discussion of the current progress and future challenges in Open Data, Open Standards, and Open Source in chemistry
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21.
3633 Accesses
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PubChem3D: Biologically relevant 3-D similarity
Sunghwan Kim, Evan E Bolton, Stephen H Bryant Journal of Cheminformatics 2011, 3:26 (22 July 2011)
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22.
3617 Accesses
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Salicylic acid functionalized silica-coated magnetite nanoparticles for solid phase extraction and preconcentration of some heavy metal ions from various real samples
M Reza Shishehbore, Abbas Afkhami, Hasan Bagheri Chemistry Central Journal 2011, 5:41 (15 July 2011)
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23.
3533 Accesses
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AZOrange - High performance open source machine learning for QSAR modeling in a graphical programming environment
Jonna C Stålring, Lars A Carlsson, Pedro Almeida, Scott Boyer Journal of Cheminformatics 2011, 3:28 (28 July 2011)
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24.
3522 Accesses
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Heavy metal ions in wines: meta-analysis of target hazard quotients reveal health risks
Declan P Naughton, Andrea Petróczi Chemistry Central Journal 2008, 2:22 (30 October 2008)
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25.
3500 Accesses
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Hollow mesoporous silica nanoparticles for intracellular delivery of fluorescent dye
Huichen Guo, Haisheng Qian, Shiqi Sun, Dehui Sun, Hong Yin, Xuepeng Cai, Zaixin Liu, Jinyan Wu, Tao Jiang, Xiangtao Liu Chemistry Central Journal 2011, 5:1 (5 January 2011)
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