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M. Mitoraj · SciRah

Researcher profile · Semantic Scholar

M. Mitoraj

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M. Mitoraj — researcher profile on SciRah

h-index: 31
Works: 116
Citations: 5,375

Most-cited papers

Palladium catalysts for dehydrogenation of ammonia borane with preferential B-H activation.
Sung-Kwan Kim, Won-Sik Han, Tae-Jin Kim, Tae-Young Kim +6 more
2010Journal of the American Chemical Society165 citations Open access
Semantic Scholar
Applications of the ETS-NOCV method in descriptions of chemical reactions
M. Mitoraj, M. Parafiniuk, M. Srebro, Michal K. Handzlik +2 more
2011Journal of Molecular Modeling111 citations Open access
Semantic Scholar
Theoretical analysis of the resonance assisted hydrogen bond based on the combined extended transition state method and natural orbitals for chemical valence scheme.
R. Kurczab, M. Mitoraj, A. Michalak, T. Ziegler
2010Journal of Physical Chemistry A95 citations Open access
Semantic Scholar
Bonding in ammonia borane: an analysis based on the natural orbitals for chemical valence and the extended transition state method (ETS-NOCV).
M. Mitoraj
2011Journal of Physical Chemistry A92 citations Open access
Semantic Scholar
A coumarin-based "turn-on" fluorescent sensor for the determination of Al3+: single crystal X-ray structure and cell staining properties.
S. Guha, Sisir Lohar, Animesh Sahana, A. Banerjee +7 more
2013Dalton Transactions86 citations
Semantic Scholar
Sigma-donor and pi-acceptor properties of phosphorus ligands: an insight from the natural orbitals for chemical valence.
M. Mitoraj, A. Michalak
2010Inorganic Chemistry86 citations Open access
Semantic Scholar
Physical nature of interactions in Zn(II) complexes with 2,2'-bipyridyl: quantum theory of atoms in molecules (QTAIM), interacting quantum atoms (IQA), noncovalent interactions (NCI), and extended transition state coupled with natural orbitals for chemical valence (ETS-NOCV) comparative studies.
I. Cukrowski, J. D. de Lange, M. Mitoraj
2014Journal of Physical Chemistry A82 citations Open access
Semantic Scholar
Extended lead(II) architectures engineered via tetrel bonding interactions
G. Mahmoudi, E. Zangrando, M. Mitoraj, A. Gurbanov +5 more
201868 citations Open access
Semantic Scholar
Multiple boron-boron bonds in neutral molecules: an insight from the extended transition state method and the natural orbitals for chemical valence scheme.
M. Mitoraj, A. Michalak
2011Inorganic Chemistry66 citations Open access
Semantic Scholar
Ligand-Driven Coordination Sphere-Induced Engineering of Hybride Materials Constructed from PbCl2 and Bis-Pyridyl Organic Linkers for Single-Component Light-Emitting Phosphors.
G. Mahmoudi, A. Gurbanov, Sabina Rodríguez-Hermida, R. Carballo +6 more
2017Inorganic Chemistry61 citations Open access
Semantic Scholar
ETS-NOCV description of σ-hole bonding
Karol Dyduch, M. Mitoraj, A. Michalak
2012Journal of Molecular Modeling47 citations Open access
Semantic Scholar
Theoretical description of halogen bonding – an insight based on the natural orbitals for chemical valence combined with the extended-transition-state method (ETS-NOCV)
M. Mitoraj, A. Michalak
2012Journal of Molecular Modeling47 citations Open access
Semantic Scholar
QTAIM and ETS-NOCV analyses of intramolecular CH···HC interactions in metal complexes.
I. Cukrowski, K. Govender, M. Mitoraj, M. Srebro
2011Journal of Physical Chemistry A47 citations
Semantic Scholar
Ratiometric sensing of lysine through the formation of the pyrene excimer: experimental and computational studies.
Sisir Lohar, D. Safin, Archya Sengupta, A. Chattopadhyay +7 more
2015Chemical Communications44 citations Open access
Semantic Scholar
Luminescent mononuclear mixed ligand complexes of copper(I) with 5-phenyl-2,2'-bipyridine and triphenylphosphine.
D. Safin, M. Mitoraj, K. Robeyns, Y. Filinchuk +1 more
2015Dalton Transactions41 citations Open access
Semantic Scholar
Resonance Assisted Hydrogen Bonding Phenomenon Unveiled from Both Experiment and Theory - an Example of New Family of Ethyl N-salicylideneglycinate Dyes.
M. Mitoraj, D. S. Shapenova, A. Shiryaev, M. Bolte +6 more
2020Chemistry35 citations Open access
Semantic Scholar
Origin of Remarkably Different Acidity of Hydroxycoumarins-Joint Experimental and Theoretical Studies.
P. Nowak, F. Sagan, M. Mitoraj
2017Journal of Physical Chemistry B34 citations Open access
Semantic Scholar
Influence of the Homopolar Dihydrogen Bonding C-H⋅⋅⋅H-C on Coordination Geometry: Experimental and Theoretical Studies.
D. Safin, M. G. Babashkina, K. Robeyns, M. Mitoraj +2 more
2015Chemistry33 citations Open access
Semantic Scholar
Correction: Anion-driven tetrel bond-induced engineering of lead(ii) architectures with N′-(1-(2-pyridyl)ethylidene)nicotinohydrazide: experimental and theoretical findings
G. Mahmoudi, D. Safin, M. Mitoraj, M. Amini +4 more
2017Inorganic Chemistry Frontiers32 citations Open access
Semantic Scholar
Non-Covalent Interactions in Hydrogen Storage Materials LiN(CH3)2BH3 and KN(CH3)2BH3
F. Sagan, Radosław Filas, M. Mitoraj
201632 citations Open access
Semantic Scholar
Intramolecular hydrogen bonding controls 1,3-N,S- vs. 1,5-S,S'-coordination in Ni(II) complexes of N-thiophosphorylated thioureas RNHC(S)NHP(S)(OiPr)2.
M. G. Babashkina, D. Safin, M. Bolte, M. Srebro +4 more
2011Dalton Transactions32 citations Open access
Semantic Scholar
On the Stability of Cis‐ and Trans‐2‐Butene Isomers. An Insight Based on the FAMSEC, IQA, and ETS‐NOCV Schemes
I. Cukrowski, F. Sagan, M. Mitoraj
2016Journal of Computational Chemistry31 citations Open access
Semantic Scholar
Polymorphism driven optical properties of an anil dye
D. Safin, K. Robeyns, M. G. Babashkina, Y. Filinchuk +6 more
201631 citations Open access
Semantic Scholar
Determination of acid dissociation constants of warfarin and hydroxywarfarins by capillary electrophoresis.
P. Nowak, Paulina Olechowska, M. Mitoraj, Michał Woźniakiewicz +1 more
2015Journal of Pharmaceutical and Biomedical Analysis31 citations Open access
Semantic Scholar
Polar protic solvent-trapping polymorphism of the HgII-hydrazone coordination polymer: experimental and theoretical findings
G. Mahmoudi, A. Khandar, Jonathan M. White, M. Mitoraj +6 more
201728 citations Open access
Semantic Scholar
Origin of Binding of Ammonia–Borane to Transition-Metal-Based Catalysts: An Insight from the Charge and Energy Decomposition Method ETS-NOCV
M. Parafiniuk, M. Mitoraj
201328 citations Open access
Semantic Scholar
Theoretical description of hydrogen bonding in oxalic acid dimer and trimer based on the combined extended-transition-state energy decomposition analysis and natural orbitals for chemical valence (ETS-NOCV)
M. Mitoraj, R. Kurczab, M. Boczar, A. Michalak
2010Journal of Molecular Modeling27 citations Open access
Semantic Scholar
Novel sterically demanding Schiff base dyes: An insight from experimental and theoretical calculations
D. Safin, M. G. Babashkina, M. Bolte, A. Ptaszek +2 more
202126 citations Open access
Semantic Scholar
Chameleon-like Nature of Anagostic Interactions and Its Impact on Metalloaromaticity in Square-Planar Nickel Complexes
M. Mitoraj, M. G. Babashkina, K. Robeyns, F. Sagan +4 more
2019Organometallics26 citations Open access
Semantic Scholar
Quasi-aromatic Möbius Metal Chelates.
G. Mahmoudi, F. A. Afkhami, A. Castiñeiras, I. García-Santos +8 more
2018Inorganic Chemistry25 citations Open access
Semantic Scholar
Photobleaching of pheomelanin increases its phototoxic potential: Physicochemical studies of synthetic pheomelanin subjected to aerobic photolysis
A. Żądło, G. Szewczyk, M. Sarna, Theodore G. Camenisch +6 more
2018Pigment Cell & Melanoma Research25 citations Open access
Semantic Scholar
Analytical aspects of achiral and cyclodextrin-mediated capillary electrophoresis of warfarin and its two main derivatives assisted by theoretical modeling.
P. Nowak, Magdalena Garnysz, M. Mitoraj, F. Sagan +2 more
2015Journal of Chromatography A24 citations Open access
Semantic Scholar
Formaldehyde activation by Cu(I) and Ag(I) sites in ZSM-5: ETS-NOCV analysis of charge transfer processes
E. Broclawik, J. Zalucka, P. Kozyra, M. Mitoraj +1 more
201124 citations Open access
Semantic Scholar
Aggregation-Induced Emission-Based Sensing Platform for Selective Detection of Zn2+ : Experimental and Theoretical Investigations.
Barnali Naskar, Anamika Dhara, D. Maiti, Mercedes Kukułka +5 more
2019ChemPhysChem23 citations Open access
Semantic Scholar
On the asymmetry in molybdenum–oxygen bonding in the MoO3 structure: ETS–NOCV analysis
M. Mitoraj, A. Michalak
2012Structural Chemistry23 citations Open access
Semantic Scholar
Clarifying notes on the bonding analysis adopted by the energy decomposition analysis.
F. Bickelhaupt, Célia Fonseca Guerra, M. Mitoraj, Filip Sagan +3 more
2022Physical Chemistry, Chemical Physics - PCCP22 citations Open access
Semantic Scholar
New Insights into Charge Flow Processes and Their Impact on the Activation of Ethene and Ethyne by Cu(I) and Ag(I) Sites in MFI
E. Broclawik, J. Zalucka, P. Kozyra, M. Mitoraj +1 more
201022 citations Open access
Semantic Scholar
Nucleic Acid Quadruplexes Based on 8-Halo-9-deazaxanthines: Energetics and Noncovalent Interactions in Quadruplex Stems.
Yevgen P. Yurenko, J. Novotný, M. Mitoraj, V. Sklenar +2 more
2014Journal of Chemical Theory and Computation21 citations Open access
Semantic Scholar
Solvent-induced 1,3-N,S- vs. 1,5-S,S′-coordination in the NiII complex [Ni{p-Me2NC6H4NHC(S)NP(S)(OiPr)2}2]
M. G. Babashkina, D. Safin, M. Srebro, P. Kubisiak +3 more
201121 citations Open access
Semantic Scholar
London Dispersion Forces in Crystal Packing of Thiourea Derivatives
M. Mitoraj, M. G. Babashkina, A. Isaev, Yana M. Chichigina +3 more
2018Crystal Growth & Design19 citations Open access
Semantic Scholar
Protonated alcohols are examples of complete charge-shift bonds.
Peter Anderson, Alban S. Petit, Jun-Ming Ho, M. Mitoraj +5 more
2014Journal of Organic Chemistry19 citations Open access
Semantic Scholar
Thermodynamics of acid-base dissociation of several cathinones and 1-phenylethylamine, studied by an accurate capillary electrophoresis method free from the Joule heating impact.
P. Nowak, Michał Woźniakiewicz, M. Mitoraj, F. Sagan +1 more
2018Journal of Chromatography A18 citations Open access
Semantic Scholar
Modulation of pKa by cyclodextrins; subtle structural changes induce spectacularly different behaviors
P. Nowak, Michał Woźniakiewicz, M. Mitoraj, Magdalena Garnysz +1 more
201518 citations Open access
Semantic Scholar
C═C, C≡C, and C═O Bond Activation by Coinage Metal Cations in ZSM-5 Zeolites: Quantitative Charge Transfer Resolution
P. Kozyra, E. Broclawik, M. Mitoraj, J. Datka
201318 citations Open access
Semantic Scholar
On the origin of internal rotation in ammonia borane
M. Parafiniuk, M. Mitoraj
2014Journal of Molecular Modeling17 citations Open access
Semantic Scholar
Experimental and theoretical investigations of the NiII complex with N-phosphorylated thiourea iPrNHC(S)NHP(O)(OPh)2
D. Safin, M. G. Babashkina, K. Robeyns, M. Mitoraj +3 more
201317 citations Open access
Semantic Scholar
Crucial influence of the intramolecular hydrogen bond on the coordination mode of RC(S)NHP(S)(OiPr)2 in homoleptic complexes with Ni II
M. G. Babashkina, D. Safin, M. Srebro, P. Kubisiak +3 more
201317 citations Open access
Semantic Scholar
From Saturated BN Compounds to Isoelectronic BN/CC Counterparts: An Insight from Computational Perspective.
F. Sagan, Łukasz Piȩkoś, M. Andrzejak, M. Mitoraj
2015Chemistry16 citations Open access
Semantic Scholar
Origin of Hydrocarbons Stability from Computational Perspective - A Case Study of Ortho-Xylene Isomers.
M. Mitoraj, F. Sagan, D. Szczepanik, J. D. de Lange +3 more
2020ChemPhysChem15 citations Open access
Semantic Scholar
Kinetic and Potential Energy Contributions to a Chemical Bond from the Charge and Energy Decomposition Scheme of Extended Transition State Natural Orbitals for Chemical Valence.
F. Sagan, M. Mitoraj
2019Journal of Physical Chemistry A15 citations Open access
Semantic Scholar

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M. G. Babashkina×12
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