Kathrin H. Hopmann: search on Z-Library

The world's largest scientific articles store. 70,000,000+ articles for free.

1

Explicit versus Implicit Solvent Modeling of Raman Optical Activity Spectra

Hopmann, Kathrin H., Ruud, Kenneth, Pecul, Magdalena, Kudelski, Andrzej, Dračínský, Martin, Bouř, Petr

Journal:

Journal of Physical Chemistry B

Year:

2011

Language:

english

File:

PDF, 2.45 MB

english, 2011

2

Iron-Catalyzed Carbenoid Transfer Reactions of Vinyl Sulfoxonium Ylides: An Experimental and Computational Study

Vaitla, Janakiram, Bayer, Annette, Hopmann, Kathrin Helen

Journal:

Angewandte Chemie

Year:

2018

Language:

english

File:

PDF, 2.48 MB

english, 2018

3

On the Mechanism of Iridium-Catalyzed Asymmetric Hydrogenation of Imines and Alkenes: A Theoretical Study

Hopmann, Kathrin Helen, Bayer, Annette

Journal:

Organometallics

Year:

2011

Language:

english

File:

PDF, 3.21 MB

english, 2011

4

Rhodium-Catalyzed Hydrocarboxylation: Mechanistic Analysis Reveals Unusual Transition State for Carbon–Carbon Bond Formation

Pavlovic, Ljiljana, Vaitla, Janakiram, Bayer, Annette, Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2018

Language:

english

File:

PDF, 2.30 MB

english, 2018

5

Cobalt-Catalysed Alkene Hydrogenation: A Metallacycle Can Explain the Hydroxyl Activating Effect and the Diastereoselectivity

Morello, Glenn, Zhong, Hongyu, Chirik, Paul, Hopmann, Kathrin H.

Journal:

Chemical Science

Year:

2018

Language:

english

File:

PDF, 1.07 MB

english, 2018

6

Iron-Catalyzed Carbenoid Transfer Reactions of Vinyl Sulfoxonium Ylides: An Experimental and Computational Study

Vaitla, Janakiram, Bayer, Annette, Hopmann, Kathrin Helen

Journal:

Angewandte Chemie International Edition

Year:

2018

Language:

english

File:

PDF, 2.48 MB

english, 2018

7

Theoretical Investigation of the Second-Shell Mechanism of Nitrile Hydratase

Kathrin H. Hopmann, Fahmi Himo

Journal:

European Journal of Inorganic Chemistry

Year:

2008

Language:

english

File:

PDF, 576 KB

english, 2008

8

Caesium Fluoride-Mediated Hydrocarboxylation of Alkenes and Allenes: Scope and Mechanistic Insights

Gevorgyan, Ashot, Obst, Marc F., Guttormsen, Yngve, Maseras, Feliu, Hopmann, Kathrin H., Bayer, Annette

Journal:

Chemical Science

Year:

2019

Language:

english

File:

PDF, 1.27 MB

english, 2019

9

Static polarizabilities at the basis set limit: A benchmark of 124 species

Brakestad, Anders, Jensen, Stig Rune, Wind, Peter, D'Alessandro, Marco, Genovese, Luigi, Hopmann, Kathrin H, Frediani, Luca

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 958 KB

2020

10

Determining the Absolute Configuration of Two Marine Compounds Using Vibrational Chiroptical Spectroscopy

Hopmann, Kathrin H., Šebestík, Jaroslav, Novotná, Jana, Stensen, Wenche, Urbanová, Marie, Svenson, Johan, Svendsen, John Sigurd, Bouř, Petr, Ruud, Kenneth

Journal:

Journal of Organic Chemistry

Year:

2012

Language:

english

File:

PDF, 2.20 MB

english, 2012

11

Understanding the Unusually Straight: A Search For MO Insights into Linear {FeNO} 7 Units

Conradie, Jeanet, Hopmann, Kathrin H., Ghosh, Abhik

Journal:

Journal of Physical Chemistry B

Year:

2010

Language:

english

File:

PDF, 4.66 MB

english, 2010

12

FemEx-female excellence in theoretical and computational chemistry

Mennucci, Benedetta, Eisenstein, Odile, Fliegl, Heike, Hopmann, Kathrin H., Helgaker, Trygve, Ruud, Kenneth

Journal:

International Journal of Quantum Chemistry

Year:

2015

Language:

english

File:

PDF, 100 KB

english, 2015

13

Carbon-carbon bonds with CO 2 : Insights from computational studies

Obst, Marc, Pavlovic, Ljiljana, Hopmann, Kathrin H.

Journal:

Journal of Organometallic Chemistry

Year:

2018

Language:

english

File:

PDF, 1.45 MB

english, 2018

14

ChemInform Abstract: Enantioselective Imine Hydrogenation with Iridium-Catalysts: Reactions, Mechanisms and Stereocontrol

Hopmann, Kathrin Helen, Bayer, Annette

Journal:

Year:

2015

File:

PDF, 12 KB

2015

15

Determination of Absolute Configuration and Conformation of a Cyclic Dipeptide by NMR and Chiral Spectroscopic Methods

Li, Xiaojun, Hopmann, Kathrin H., Hudecová, Jana, Isaksson, Johan, Novotná, Jana, Stensen, Wenche, Andrushchenko, Valery, Urbanová, Marie, Svendsen, John-Sigurd, Bouř, Petr, Ruud, Kenneth

Journal:

Journal of Physical Chemistry A

Year:

2013

Language:

english

File:

PDF, 2.90 MB

english, 2013

16

Quantum Chemical Modeling of the Dehalogenation Reaction of Haloalcohol Dehalogenase

Hopmann, Kathrin H., Himo, Fahmi

Journal:

Journal of Chemical Theory and Computation

Year:

2008

Language:

english

File:

PDF, 2.27 MB

english, 2008

17

Theoretical Investigation of the First-Shell Mechanism of Nitrile Hydratase

Hopmann, Kathrin H., Guo, Jing-Dong, Himo, Fahmi

Journal:

Inorganic Chemistry

Year:

2007

Language:

english

File:

PDF, 510 KB

english, 2007

18

How To Make Your Computational Paper Interesting and Have It Published

Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2019

Language:

english

File:

PDF, 1.22 MB

english, 2019

19

Broken-Symmetry DFT Spin Densities of Iron Nitrosyls, Including Roussin’s Red and Black Salts: Striking Differences between Pure and Hybrid Functionals

Hopmann, Kathrin H., Conradie, Jeanet, Ghosh, Abhik

Journal:

Journal of Physical Chemistry B

Year:

2009

Language:

english

File:

PDF, 2.00 MB

english, 2009

20

A Polymer Magician: Professor Charlotte K. Williams

Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2020

File:

PDF, 1.13 MB

2020

21

Catalytic Mechanism of Limonene Epoxide Hydrolase, a Theoretical Study

Hopmann, Kathrin H., Hallberg, B. Martin, Himo, Fahmi

Journal:

Journal of the American Chemical Society

Year:

2005

Language:

english

File:

PDF, 500 KB

english, 2005

22

Comprehensive Natural Products II || Quantum Chemical Modeling of Enzymatic Reactions – Applications to Epoxide-Transforming Enzymes

Hopmann, Kathrin H.

Year:

2010

Language:

english

File:

PDF, 2.01 MB

english, 2010

23

Mechanistic Insights into Copper-Catalyzed Carboxylations

Obst, Marc F., Gevorgyan, Ashot, Bayer, Annette, Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2020

File:

PDF, 2.03 MB

2020

24

Cover Picture: Hemoglobin as a Nitrite Anhydrase: Modeling Methemoglobin-Mediated N2O3 Formation (Chem. Eur. J. 23/2011)

Dr. Kathrin H. Hopmann, Dr. Bruno Cardey, Prof. Mark T. Gladwin, Prof. Daniel B. Kim-Shapiro, Prof. Abhik Ghosh

Journal:

Chemistry - A European Journal

Year:

2011

Language:

english

File:

PDF, 1.02 MB

english, 2011

25

On the Role of Tyrosine as Catalytic Base in Nitrile Hydratase

Kathrin H. Hopmann, Fahmi Himo

Journal:

European Journal of Inorganic Chemistry

Year:

2008

Language:

english

File:

PDF, 653 KB

english, 2008

26

Substitution and Isomerization of Asymmetric β-Diketonato Rhodium(I) Complexes: A Crystallographic and Computational Study

Hopmann, Kathrin H., Stuurman, Nomampondomise F., Muller, Alfred, Conradie, Jeanet

Journal:

Organometallics

Year:

2010

Language:

english

File:

PDF, 4.49 MB

english, 2010

27

Mechanistic Insights into Copper-Catalyzed Carboxylations

Obst, Marc F., Gevorgyan, Ashot, Bayer, Annette, Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2020

Language:

english

File:

PDF, 2.03 MB

english, 2020

28

Rhodium-Catalyzed Synthesis of Sulfur Ylides via in Situ Generated Iodonium Ylides

Vaitla, Janakiram, Hopmann, Kathrin H., Bayer, Annette

Journal:

Organic Letters

Year:

2017

Language:

english

File:

PDF, 1.09 MB

english, 2017

29

How To Make Your Computational Paper Interesting and Have It Published

Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2019

File:

PDF, 1.22 MB

2019

30

Exploration of New Biomass‐Derived Solvents: Application to Carboxylation Reactions

Gevorgyan, Ashot, Hopmann, Kathrin H., Bayer, Annette

Journal:

Year:

2020

File:

PDF, 2.29 MB

2020

31

Full Reaction Mechanism of Nitrile Hydratase: A Cyclic Intermediate and an Unexpected Disulfide Switch

Hopmann, Kathrin H.

Journal:

Inorganic Chemistry

Year:

2014

Language:

english

File:

PDF, 1.76 MB

english, 2014

32

Quantum chemical studies of asymmetric reactions: Historical aspects and recent examples

Hopmann, Kathrin H.

Journal:

International Journal of Quantum Chemistry

Year:

2015

Language:

english

File:

PDF, 1.61 MB

english, 2015

33

Synthesis of Indoles and Pyrroles Utilizing Iridium Carbenes Generated from Sulfoxonium Ylides

Vaitla, Janakiram, Bayer, Annette, Hopmann, Kathrin H.

Journal:

Angewandte Chemie

Year:

2017

Language:

english

File:

PDF, 912 KB

english, 2017

34

Theoretical Study of the Full Reaction Mechanism of Human Soluble Epoxide Hydrolase

Kathrin H. Hopmann, Fahmi Himo

Journal:

Chemistry - A European Journal

Year:

2006

Language:

english

File:

PDF, 698 KB

english, 2006

35

Spin Coupling in Roussin’s Red and Black Salts

Dr. Kathrin H. Hopmann, Prof. Dr. Louis Noodleman, Prof. Dr. Abhik Ghosh

Journal:

Chemistry - A European Journal

Year:

2010

Language:

english

File:

PDF, 1.22 MB

english, 2010

36

Caesium Fluoride-Mediated Hydrocarboxylation of Alkenes and Allenes: Scope and Mechanistic Insights

Gevorgyan, Ashot, Obst, Marc F., Guttormsen, Yngve, Maseras, Feliu, Hopmann, Kathrin H., Bayer, Annette

Journal:

Chemical Science

Year:

2019

File:

PDF, 1.27 MB

2019

37

Absolute Configuration of a Cyclic Dipeptide Reflected in Vibrational Optical Activity: Ab Initio and Experimental Investigation

Li, Xiaojun, Hopmann, Kathrin H., Hudecová, Jana, Stensen, Wenche, Novotná, Jana, Urbanová, Marie, Svendsen, John-Sigurd, Bouř, Petr, Ruud, Kenneth

Journal:

Journal of Physical Chemistry A

Year:

2012

Language:

english

File:

PDF, 5.06 MB

english, 2012

38

A dihydride mechanism can explain the intriguing substrate selectivity of iron-PNP-mediated hydrogenation

Morello, Glenn R., Hopmann, Kathrin H

Journal:

Year:

2017

Language:

english

File:

PDF, 873 KB

english, 2017

39

Substitution reactions of dichlorobis(betadiketonato-O,O′)titanium(IV) complexes with aryl diolato ligands: An experimental and computational study

Hopmann, Kathrin H., Kuhn, Annemarie, Conradie, Jeanet

Journal:

Year:

2014

Language:

english

File:

PDF, 1.60 MB

english, 2014

40

Substrate specificity of the metalloproteinase pregnancy-associated plasma protein-A (PAPP-A) assessed by mutagenesis and analysis of synthetic peptides: substrate residues distant from the scissile bond are critical for proteolysis

LAURSEN, Lisbeth S., OVERGAARD, Michael T., NIELSEN, Claus G., BOLDT, Henning B., HOPMANN, Kathrin H., CONOVER, Cheryl A., SOTTRUP-JENSEN, Lars, GIUDICE, Linda C., OXVIG, Claus

Journal:

Biochemical Journal

Year:

2002

Language:

english

File:

PDF, 230 KB

english, 2002

41

To Bind or Not to Bind: Mechanistic Insights into CâCO 2 Bond Formation with Late Transition Metals

GarcÃa-LÃ³pez, Diego, Pavlovic, Ljiljana, Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2020

Language:

english

File:

PDF, 1.93 MB

english, 2020

42

Iridium-PHOX-Mediated Alkene Hydrogenation: Isomerization Influences the Stereochemical Outcome

Hopmann, Kathrin H., Frediani, Luca, Bayer, Annette

Journal:

Organometallics

Year:

2014

Language:

english

File:

PDF, 2.55 MB

english, 2014

43

Correction to Density Functional Theory Calculations on Mössbauer Parameters of Nonheme Iron Nitrosyls

Hopmann, Kathrin H., Ghosh, Abhik, Noodleman, Louis

Journal:

Inorganic Chemistry

Year:

2011

File:

PDF, 594 KB

2011

44

Iron/Brønsted Acid Catalyzed Asymmetric Hydrogenation: Mechanism and Selectivity-Determining Interactions

Hopmann, Kathrin H.

Journal:

Chemistry - A European Journal

Year:

2015

Language:

english

File:

PDF, 2.48 MB

english, 2015

45

Correction of Vibrational Broadening in Molecular Dynamics Clusters with the Normal Mode Optimization Method

Hudecová, Jana, Hopmann, Kathrin H., Bouř, Petr

Journal:

Journal of Physical Chemistry B

Year:

2012

Language:

english

File:

PDF, 935 KB

english, 2012

46

Density Functional Theory Study of Substitution at the Square-Planar Acetylacetonato-dicarbonyl-rhodium(I) Complex

Hopmann, Kathrin Helen, Conradie, Jeanet

Journal:

Organometallics

Year:

2009

Language:

english

File:

PDF, 2.23 MB

english, 2009

47

Organometallic Chemistry for Enabling Carbon Dioxide Utilization

Hazari, Nilay, Iwasawa, Nobuharu, Hopmann, Kathrin H.

Journal:

Organometallics

Year:

2020

File:

PDF, 3.33 MB

2020

48

Ni(I)âAlkyl Complexes Bearing Phenanthroline Ligands: Experi-mental Evidence for CO2 Insertion at Ni(I) Centers

Somerville, Rosie J, Odena, Carlota, Obst, Marc, Hazari, Nilay, Hopmann, Kathrin H, Martin, Ruben

Journal:

Journal of the American Chemical Society

Year:

2020

File:

PDF, 1.80 MB

2020

49

Hemoglobin as a Nitrite Anhydrase: Modeling Methemoglobin-Mediated N2O3 Formation

Dr. Kathrin H. Hopmann, Dr. Bruno Cardey, Prof. Mark T. Gladwin, Prof. Daniel B. Kim-Shapiro, Prof. Abhik Ghosh

Journal:

Chemistry - A European Journal

Year:

2011

Language:

english

File:

PDF, 1.10 MB

english, 2011

50

Calibration of DFT Functionals for the Prediction of 57 Fe Mössbauer Spectral Parameters in Iron–Nitrosyl and Iron–Sulfur Complexes: Accurate Geometries Prove Essential

Sandala, Gregory M., Hopmann, Kathrin H., Ghosh, Abhik, Noodleman, Louis

Journal:

Journal of Chemical Theory and Computation

Year:

2011

Language:

english

File:

PDF, 1.69 MB

english, 2011

To build up a library is to create a life. It’s never just a random collection of books.

— Carlos María Domínguez

Official channel

Z-Library Desktop Launcher

Z-Library Since 2009 support@1delivery.pm

EnglishРусскийEspañolItalianoελληνικάاللغة العربيةBahasa IndonesiaBahasa Malaysiaहिन्दीDeutschFrançaisPortuguêsУкраїнськаPolski中文繁體中文日本語Tiếng ViệtAzərbaycan DiliՀայոց լեզուภาษาไทยTürk Diliქართველიবাংলাپښتوతెలుగుاردو한국어SrpskiБългарски