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26.

11779
Accesses

Editorial   Open Access Highly Accessed

Welcome Home, Systems Chemists!

Günter von Kiedrowski, Sijbren Otto, Piet Herdewijn Journal of Systems Chemistry 2010, 1:1 (18 August 2010)

Abstract | Full text | PDF

27.

11154
Accesses

Research article   Open Access Highly Accessed

Application of the PM6 semi-empirical method to modeling proteins enhances docking accuracy of AutoDock

Zsolt Bikadi, Eszter Hazai Journal of Cheminformatics 2009, 1:15 (11 September 2009)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central | Graphical abstract

28.

11146
Accesses

Research article   Open Access Highly Accessed

GC-MS studies of the chemical composition of two inedible mushrooms of the genus Agaricus

Assya Petrova, Kalina Alipieva, Emanuela Kostadinova, Daniela Antonova, Maria Lacheva, Melania Gjosheva, Simeon Popov, Vassya Bankova Chemistry Central Journal 2007, 1:33 (20 December 2007)

Abstract | Full text | PDF | PubMed | Graphical abstract

29.

10717
Accesses

Research article   Open Access

Phosphorus retention in calcareous soils and the effect of organic matter on its mobility

Ray von Wandruszka Geochemical Transactions 2006, 7:6 (12 June 2006)

Abstract | Full text | PDF | PubMed |  Editor’s summary

A survey of the interactions between phosphorus (P) species and the components of calcareous soils shows that both surface reactions and precipitation take place, especially in the presence of calcite and limestone.

30.

10475
Accesses

Software   Open Access Highly Accessed

The JSpecView Project: an Open Source Java viewer and converter for JCAMP-DX, and XML spectral data files

Robert J Lancashire Chemistry Central Journal 2007, 1:31 (7 December 2007)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central | Graphical abstract

31.

10407
Accesses

Software   Open Access Highly Accessed

Small Molecule Subgraph Detector (SMSD) toolkit

Syed Rahman, Matthew Bashton, Gemma L Holliday, Rainer Schrader, Janet M Thornton Journal of Cheminformatics 2009, 1:12 (10 August 2009)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central

32.

10091
Accesses

Research article   Open Access Highly Accessed

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)

Abstract | Full text | PDF | PubMed | Graphical abstract

33.

10000
Accesses

Methodology   Open Access Highly Accessed

Selective masking and demasking for the stepwise complexometric determination of aluminium, lead and zinc from the same solution

Nijhuma Kayal, Nahar Singh Chemistry Central Journal 2008, 2:4 (6 March 2008)

Abstract | Full text | PDF | PubMed

34.

9741
Accesses

Research article   Open Access Highly Accessed

Collaborative development of predictive toxicology applications

Barry Hardy, Nicki Douglas, Christoph Helma, Micha Rautenberg, Nina Jeliazkova, Vedrin Jeliazkov, Ivelina Nikolova, Romualdo Benigni, Olga Tcheremenskaia, Stefan Kramer, Tobias Girschick, Fabian Buchwald, Joerg Wicker, Andreas Karwath, Martin Gütlein, Andreas Maunz, Haralambos Sarimveis, Georgia Melagraki, Antreas Afantitis, Pantelis Sopasakis, David Gallagher, Vladimir Poroikov, Dmitry Filimonov, Alexey Zakharov, Alexey Lagunin, Tatyana Gloriozova, Sergey Novikov, Natalia Skvortsova, Dmitry Druzhilovsky, Sunil Chawla, Indira Ghosh, Surajit Ray, Hitesh Patel, Sylvia Escher et al. Journal of Cheminformatics 2010, 2:7 (31 August 2010)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central | Graphical abstract

35.

9659
Accesses

Research article   Open Access Highly Accessed

Predicting olfactory receptor neuron responses from odorant structure

Michael Schmuker, Marien de Bruyne, Melanie Hähnel, Gisbert Schneider Chemistry Central Journal 2007, 1:11 (4 May 2007)

Abstract | Full text | PDF | PubMed |  Editor’s summary

Olfactory coding was mimicked by modeling responses of primary olfactory neurons to small molecules using a large set of physicochemical molecular descriptors and artificial neural networks.

36.

9587
Accesses

Research article   Open Access Highly Accessed

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)

Abstract | Full text | PDF | PubMed | Graphical abstract

37.

9582
Accesses

Research article   Open Access Highly Accessed

Microbial sulfate reduction and metal attenuation in pH 4 acid mine water

Clinton D Church, Richard T Wilkin, Charles N Alpers, Robert O Rye, R Blaine McCleskey Geochemical Transactions 2007, 8:10 (23 October 2007)

Abstract | Full text | PDF | PubMed

38.

9553
Accesses

Research article   Open Access Highly Accessed

Freezing point osmometry of milk to determine the additional water content – an issue in general quality control and German food regulation

Britta Büttel, Markus Fuchs, Birger Holz Chemistry Central Journal 2008, 2:6 (10 March 2008)

Abstract | Full text | PDF | PubMed

39.

9496
Accesses

Research article   Open Access Highly Accessed

Optimal assignment methods for ligand-based virtual screening

Andreas Jahn, Georg Hinselmann, Nikolas Fechner, Andreas Zell Journal of Cheminformatics 2009, 1:14 (25 August 2009)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central | Graphical abstract

40.

9459
Accesses

Article   Open Access

Humic acids: Their detergent qualities and potential uses in pollution remediation

Ray von Wandruszka Geochemical Transactions 2000, 1:10 (12 April 2000)

Abstract | Full text | PDF

41.

9218
Accesses

Research article   Open Access Highly Accessed

Computational molecular characterization of the flavonoid rutin

Sergio A Payán-Gómez, Norma Flores-Holguín, Antonino Pérez-Hernández, Manuel Piñón-Miramontes, Daniel Glossman-Mitnik Chemistry Central Journal 2010, 4:12 (22 June 2010)

Abstract | Full text | PDF | PubMed

42.

9216
Accesses

Research article   Open Access Highly Accessed

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)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central | Graphical abstract

43.

9212
Accesses

Research article   Open Access Highly Accessed

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)

Abstract | Full text | PDF | PubMed |  Editor’s summary | Graphical abstract

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

44.

9152
Accesses

Methodology   Open Access Highly Accessed

Automated extraction of chemical structure information from digital raster images

Jungkap Park, Gus R Rosania, Kerby A Shedden, Mandee Nguyen, Naesung Lyu, Kazuhiro Saitou Chemistry Central Journal 2009, 3:4 (5 February 2009)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central

45.

9051
Accesses

Research article   Open Access Highly Accessed

Facile solution-phase synthesis of γ-Mn3O4 hierarchical structures

Zhengcui Wu, Kuai Yu, Yaobin Huang, Cheng Pan, Yi Xie Chemistry Central Journal 2007, 1:8 (17 March 2007)

Abstract | Full text | PDF | PubMed

46.

9011
Accesses

Research article   Open Access Highly Accessed

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)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central | Graphical abstract

47.

8942
Accesses

Research article   Open Access Highly Accessed

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)

Abstract | Full text | PDF | PubMed | Graphical abstract

48.

8913
Accesses

Research article   Open Access Highly Accessed

Solvent effect on the spectral properties of Neutral Red

Muhammad A Rauf, Ahmed A Soliman, Muhammad Khattab Chemistry Central Journal 2008, 2:19 (18 September 2008)

Abstract | Full text | PDF | PubMed

49.

8903
Accesses

Methodology   Open Access Highly Accessed

Isolation, purification, and full NMR assignments of cyclopamine from Veratrum californicum

John E Oatis, Pam Brunsfeld, James W Rushing, Peter D Moeller, Daniel W Bearden, Thomas N Gallien, George Cooper Chemistry Central Journal 2008, 2:12 (24 June 2008)

Abstract | Full text | PDF | PubMed | Graphical abstract

50.

8864
Accesses

Research article   Open Access Highly Accessed

Characterization of Italian honeys (Marche Region) on the basis of their mineral content and some typical quality parameters

Marcelo Conti, Jorge Stripeikis, Luigi Campanella, Domenico Cucina, Mabel Tudino Chemistry Central Journal 2007, 1:14 (7 June 2007)

Abstract | Full text | PDF | PubMed

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