Crina-Maria Ionescu
According to our database1,
Crina-Maria Ionescu
authored at least 21 papers
between 2011 and 2023.
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Bibliography
2023
Mol* Volumes and Segmentations: visualization and interpretation of cell imaging data alongside macromolecular structure data and biological annotations.
Nucleic Acids Res., July, 2023
2017
Bioinform., 2017
2015
ValidatorDB: database of up-to-date validation results for ligands and non-standard residues from the Protein Data Bank.
Nucleic Acids Res., 2015
PatternQuery: web application for fast detection of biomacromolecular structural patterns in the entire Protein Data Bank.
Nucleic Acids Res., 2015
How Does the Methodology of 3D Structure Preparation Influence the Quality of p<i>K</i><sub>a</sub> Prediction?
J. Chem. Inf. Model., 2015
AtomicChargeCalculator: interactive web-based calculation of atomic charges in large biomolecular complexes and drug-like molecules.
J. Cheminformatics, 2015
2014
MotiveValidator: interactive web-based validation of ligand and residue structure in biomolecular complexes.
Nucleic Acids Res., 2014
J. Cheminformatics, 2014
2013
Rapid Calculation of Accurate Atomic Charges for Proteins via the Electronegativity Equalization Method.
J. Chem. Inf. Model., 2013
J. Cheminformatics, 2013
2012
Charge Profile Analysis Reveals That Activation of Pro-apoptotic Regulators Bax and Bak Relies on Charge Transfer Mediated Allosteric Regulation.
PLoS Comput. Biol., 2012
Nucleic Acids Res., 2012
J. Chem. Inf. Model., 2012
J. Cheminformatics, 2012
SiteBinder - an improved approach for comparing multiple protein structural motifs. Case studies on biologically important motifs.
J. Cheminformatics, 2012
Searching for tunnels of proteins - comparison of approaches and available software tools.
J. Cheminformatics, 2012
2011
Predicting p<i>K</i><sub>a</sub> Values of Substituted Phenols from Atomic Charges: Comparison of Different Quantum Mechanical Methods and Charge Distribution Schemes.
J. Chem. Inf. Model., 2011
QSPR designer - a program to design and evaluate QSPR models. Case study on pK<sub>a</sub> prediction.
J. Cheminformatics, 2011