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Radka Svobodová Vareková

◀ ▶ joint publications with Tomás Bouchal

> Home > Persons > Radka Svobodová Vareková

Publications

2015
[j27]
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  - journals/jcheminf/IonescuSFPPBVGK15
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  - https://dblp.org/rec/journals/jcheminf/IonescuSFPPBVGK15
Crina-Maria Ionescu, David Sehnal, Francesco L. Falginella, Purbaj Pant, Lukás Pravda, Tomás Bouchal, Radka Svobodová Vareková, Stanislav Geidl, Jaroslav Koca:
AtomicChargeCalculator: interactive web-based calculation of atomic charges in large biomolecular complexes and drug-like molecules. J. Cheminformatics 7: 50:1-50:13 (2015)
[j26]
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  - journals/jcheminf/GeidlBRVHKAK15
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  - https://dblp.org/rec/journals/jcheminf/GeidlBRVHKAK15
Stanislav Geidl, Tomás Bouchal, Tomás Racek, Radka Svobodová Vareková, Václav Hejret, Ales Krenek, Ruben Abagyan, Jaroslav Koca:
High-quality and universal empirical atomic charges for chemoinformatics applications. J. Cheminformatics 7: 59:1-59:10 (2015)
2014
[j20]
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  - journals/jcheminf/BouchalVRIGKK14
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  - https://dblp.org/rec/journals/jcheminf/BouchalVRIGKK14
Tomás Bouchal, Radka Svobodová Vareková, Tomás Racek, Crina-Maria Ionescu, Stanislav Geidl, Ales Krenek, Jaroslav Koca:
Empirical charges for chemoinformatics applications. J. Cheminformatics 6(S-1): 60 (2014)
2013
[j17]
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  - journals/jcheminf/VarekovaGISBSAK13
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  - https://dblp.org/rec/journals/jcheminf/VarekovaGISBSAK13
Radka Svobodová Vareková, Stanislav Geidl, Crina-Maria Ionescu, Ondrej Skrehota, Tomás Bouchal, David Sehnal, Ruben Abagyan, Jaroslav Koca:
Predicting pKa values from EEM atomic charges. J. Cheminformatics 5: 18 (2013)
2012
[j11]
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  - journals/jcheminf/GeidlBVBBKSK12
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  - https://dblp.org/rec/journals/jcheminf/GeidlBVBBKSK12
Stanislav Geidl, Roman Beránek, Radka Svobodová Vareková, Tomás Bouchal, Miroslav Brumovský, Michal Kudera, Ondrej Skrehota, Jaroslav Koca:
How the methodology of 3D structure preparation influences the quality of QSPR models? J. Cheminformatics 4(S-1): 61 (2012)
2011
[j6]
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  - journals/jcisd/VarekovaGISKSBAHK11
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  - https://dblp.org/rec/journals/jcisd/VarekovaGISKSBAHK11
Radka Svobodová Vareková, Stanislav Geidl, Crina-Maria Ionescu, Ondrej Skrehota, Michal Kudera, David Sehnal, Tomás Bouchal, Ruben Abagyan, Heinrich J. Huber, Jaroslav Koca:
Predicting pK_a Values of Substituted Phenols from Atomic Charges: Comparison of Different Quantum Mechanical Methods and Charge Distribution Schemes. J. Chem. Inf. Model. 51(8): 1795-1806 (2011)

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