Á. Madarász

发表

A Catalyst Designed for the Enantioselective Construction of Methyl- and Alkyl-Substituted Tertiary Stereocenters.

I. Pápai, P. Pihko, Aurélie Claraz, 2016, Angewandte Chemie.

Nuclear Quantum Effects from the Analysis of Smoothed Trajectories: Pilot Study for Water

I. Bakó, D. Berta, Á. Madarász, 2020, Journal of chemical theory and computation.

Comment on “Does the Hydrated Electron Occupy a Cavity?”

L. Túri, Á. Madarász, 2011, Science.

Stereocontrol in Diphenylprolinol Silyl Ether Catalyzed Michael Additions: Steric Shielding or Curtin-Hammett Scenario?

I. Pápai, P. Nagy, Ágnes Révész, 2017, Journal of the American Chemical Society.

Thiourea Derivatives as Brønsted Acid Organocatalysts

A. Csámpai, I. Pápai, T. Soós, 2016 .

Multiscale Modeling of Electronic Spectra Including Nuclear Quantum Effects

A. Stirling, P. Fehér, Á. Madarász, 2021, Journal of chemical theory and computation.

A frustrated-Lewis-pair approach to catalytic reduction of alkynes to cis-alkenes

M. Leskelä, T. Repo, I. Pápai, 2013, Nature Chemistry.

Dual hydrogen-bond/enamine catalysis enables a direct enantioselective three-component domino reaction.

I. Pápai, P. Pihko, H. Rahaman, 2011, Angewandte Chemie.

Two Faces of the Two-Phase Thermodynamic Model

I. Bakó, A. Hamza, Á. Madarász, 2021, Journal of chemical theory and computation.

Cross‐Dehydrogenative Couplings Between Indoles and β‐Keto Esters: Ligand‐Assisted Ligand Tautomerization and Dehydrogenation via a Proton‐Assisted Electron Transfer to Pd(II).

I. Pápai, P. Pihko, A. Vuorinen, 2014 .

A Cyclobutene‐1,2‐bis(imidazolium) Salt as Preligand for Palladium‐Catalyzed Cross‐Coupling Reactions: Properties and Applications

I. Pápai, A. Rahimi, J. Namyslo, 2012 .

Cross-dehydrogenative couplings between indoles and β-keto esters: ligand-assisted ligand tautomerization and dehydrogenation via a proton-assisted electron transfer to Pd(II).

I. Pápai, P. Pihko, A. Vuorinen, 2014, Journal of the American Chemical Society.

Dihydrooxazine oxides as key intermediates in organocatalytic Michael additions of aldehydes to nitroalkenes.

I. Pápai, P. Pihko, A. Valkonen, 2012, Angewandte Chemie.

Organocatalysts Fold To Generate an Active Site Pocket for the Mannich Reaction

I. Pápai, P. Pihko, T. Földes, 2017 .

Air-stable 18-electron adducts of Schrock catalysts with tuned stability constants for spontaneous release of the active species

I. Pápai, J. Benet‐Buchholz, E. Martín, 2021, Communications Chemistry.

Excess electron relaxation dynamics at water/air interfaces.

P. Rossky, L. Túri, Á. Madarász, 2007, The Journal of chemical physics.

Interior- and surface-bound excess electron states in large water cluster anions.

P. Rossky, L. Túri, Á. Madarász, 2009, The Journal of chemical physics.

Excess electron localization sites in neutral water clusters.

P. Rossky, L. Túri, Á. Madarász, 2006, The Journal of chemical physics.

Development of a True Transition State Force Field from Quantum Mechanical Calculations.

Robert S Paton, R. Paton, Ádám Madarász, 2016, Journal of chemical theory and computation.

A Practice‐Oriented Benchmark Strategy to Predict the UV‐Vis Spectra of Organic Photocatalysts**

A. Stirling, P. Fehér, Á. Madarász, 2023, Chemistry–Methods.

Cooperative assistance in bifunctional organocatalysis: enantioselective Mannich reactions with aliphatic and aromatic imines.

K. Rissanen, I. Pápai, P. Pihko, 2012, Angewandte Chemie.

Structure of BRIJ-35 nonionic surfactant in water: a reverse Monte Carlo study.

G. Tóth, Á. Madarász, 2006, Langmuir : the ACS journal of surfaces and colloids.

Prediction of Redox Power for Photocatalysts: Synergistic Combination of DFT and Machine Learning

A. Stirling, P. Fehér, Á. Madarász, 2023, Journal of chemical theory and computation.