Publications by authors named "Valentin Georgiev"

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Uranium Determination in Waters, Wine and Honey by Solid Phase Extraction with New Ion Imprinted Polymer.
Valentin Georgiev, Ivanka Dakova, Irina Karadjova

Molecules· August 2022

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Efficient iterative virtual screening with Apache Spark and conformal prediction.
Laeeq Ahmed, Valentin Georgiev, Marco Capuccini, Salman Toor, Wesley Schaal

J Cheminform· March 2018

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A unified proteochemometric model for prediction of inhibition of cytochrome p450 isoforms.
Maris Lapins, Apilak Worachartcheewan, Ola Spjuth, Valentin Georgiev, Virapong Prachayasittikul

PLoS One· March 2014

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Open source drug discovery with bioclipse.
Ola Spjuth, Lars Carlsson, Jonathan Alvarsson, Valentin Georgiev, Egon Willighagen

Curr Top Med Chem· July 2013

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Bioclipse-R: integrating management and visualization of life science data with statistical analysis.
Ola Spjuth, Valentin Georgiev, Lars Carlsson, Jonathan Alvarsson, Arvid Berg

Bioinformatics· January 2013

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The alkenyl migration mechanism catalyzed by extradiol dioxygenases: a hybrid DFT study.
Tomasz Borowski, Anna Wójcik, Anna Miłaczewska, Valentin Georgiev, Margareta R A Blomberg

J Biol Inorg Chem· August 2012

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Theoretical insights into heme-catalyzed oxidation of cyclohexane to adipic acid.
Holger Noack, Valentin Georgiev, Margareta R A Blomberg, Per E M Siegbahn, Adam Johannes Johansson

Inorg Chem· February 2011

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On the observation of a gem diol intermediate after O-O bond cleavage by extradiol dioxygenases. A hybrid DFT study.
Tomasz Borowski, Valentin Georgiev, Per E M Siegbahn

J Mol Model· November 2010

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DFT study on the catalytic reactivity of a functional model complex for intradiol-cleaving dioxygenases.
Valentin Georgiev, Holger Noack, Tomasz Borowski, Margareta R A Blomberg, Per E M Siegbahn

J Phys Chem B· May 2010

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A comparison of the reaction mechanisms of iron- and manganese-containing 2,3-HPCD: an important spin transition for manganese.
Valentin Georgiev, Tomasz Borowski, Margareta R A Blomberg, Per E M Siegbahn

J Biol Inorg Chem· August 2008

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Theoretical study of the catalytic reaction mechanism of MndD.
Valentin Georgiev, Tomasz Borowski, Per E M Siegbahn

J Biol Inorg Chem· July 2006

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Catalytic reaction mechanism of homogentisate dioxygenase: a hybrid DFT study.
Tomasz Borowski, Valentin Georgiev, Per E M Siegbahn

J Am Chem Soc· December 2005

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