Rafał A. Bachorz
Rafał A. Bachorz
Institue of Medical Biology of Polish Academy of Sciences
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Low-temperature polymorphs of Zr O 2 and Hf O 2: A density-functional theory study
JE Jaffe, RA Bachorz, M Gutowski
Physical Review B 72 (14), 144107, 2005
Strong N− H··· π hydrogen bonding in amide− benzene interactions
P Ottiger, C Pfaffen, R Leist, S Leutwyler, RA Bachorz, W Klopper
The Journal of Physical Chemistry B 113 (9), 2937-2943, 2009
The MP2‐F12 method in the TURBOMOLE program package
RA Bachorz, FA Bischoff, A Glöß, C Hättig, S Höfener, W Klopper, DP Tew
Journal of Computational Chemistry 32 (11), 2492-2513, 2011
Scope and limitations of the SCS-MP2 method for stacking and hydrogen bonding interactions
RA Bachorz, FA Bischoff, S Höfener, W Klopper, P Ottiger, R Leist, JA Frey, ...
Physical Chemistry Chemical Physics 10 (19), 2758-2766, 2008
Electron-driven acid-base chemistry: proton transfer from hydrogen chloride to ammonia
SN Eustis, D Radisic, KH Bowen, RA Bachorz, M Haranczyk, GK Schenter, ...
Science 319 (5865), 936-939, 2008
Stabilization of very rare tautomers of uracil by an excess electron
RA Bachorz, J Rak, M Gutowski
Physical Chemistry Chemical Physics 7 (10), 2116-2125, 2005
Nucleobase-Fluorobenzene Interactions: Hydrogen Bonding Wins over p Stacking
R Leist, JA Frey, P Ottiger, HM Frey, S Leutwyler, RA Bachorz, W Klopper
Coupled-cluster and explicitly correlated perturbation-theory calculations of the uracil anion
RA Bachorz, W Klopper, M Gutowski
The Journal of chemical physics 126 (8), 2007
Accurate computational thermochemistry from explicitly correlated coupled-cluster theory
W Klopper, RA Bachorz, C Hättig, DP Tew
Theoretical Chemistry Accounts 126, 289-304, 2010
Photoelectron spectroscopy of adiabatically bound valence anions of rare tautomers of the nucleic acid bases
X Li, KH Bowen, M Haranczyk, RA Bachorz, K Mazurkiewicz, J Rak, ...
The Journal of chemical physics 127 (17), 2007
Excess Electron Attachment Induces Barrier-Free Proton Transfer in Binary Complexes of Uracil with H2Se and H2S but Not with H2O
M Harańczyk, R Bachorz, J Rak, M Gutowski, D Radisic, ST Stokes, ...
The Journal of Physical Chemistry B 107 (31), 7889-7895, 2003
Sub-meV accuracy in first-principles computations of the ionization potentials and electron affinities of the atoms H to Ne
W Klopper, RA Bachorz, DP Tew, C Hättig
Physical Review A 81 (2), 022503, 2010
Photoelectron spectrum of valence anions of uracil and first-principles calculations of excess electron binding energies
RA Bachorz, W Klopper, M Gutowski, X Li, KH Bowen
The Journal of chemical physics 129 (5), 2008
Rovibrational energy levels of H3+ with energies above the barrier to linearity
RA Bachorz, W Cencek, R Jaquet, J Komasa
The Journal of chemical physics 131 (2), 2009
On the unusual stability of valence anions of thymine based on very rare tautomers: a computational study
K Mazurkiewicz, RA Bachorz, M Gutowski, J Rak
The Journal of Physical Chemistry B 110 (48), 24696-24707, 2006
Synthesis of naphthalimide-carborane and metallacarborane conjugates: Anticancer activity, DNA binding ability
J Nekvinda, D Różycka, S Rykowski, E Wyszko, A Fedoruk-Wyszomirska, ...
Bioorganic Chemistry 94, 103432, 2020
Anion of the formic acid dimer as a model for intermolecular proton transfer induced by a π* excess electron
RA Bachorz, M Harańczyk, I Dąbkowska, J Rak, M Gutowski
The Journal of chemical physics 122 (20), 2005
The cardenolides strophanthidin, digoxigenin and dihydroouabain act as activators of the human RORγ/RORγT receptors
K Karaś, A Sałkowska, A Walczak-Drzewiecka, K Ryba, J Dastych, ...
Toxicology Letters 295, 314-324, 2018
Cardiac glycosides with target at direct and indirect interactions with nuclear receptors
K Karaś, A Sałkowska, J Dastych, RA Bachorz, M Ratajewski
Biomedicine & Pharmacotherapy 127, 110106, 2020
Ab initio theory for accurate spectroscopic constants and molecular properties
DP Tew, W Klopper, RA Bachorz, C Hättig
Handbook of High‐resolution Spectroscopy, 2011
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Artículos 1–20