Timothy Clark - Dissemin

Papers authored by Timothy Clark

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2012 Tatyana E. Shubina, Matthias Freund, Sebastian Schenker, Timothy Clark

, Svetlana B. Tsogoeva

Synthesis and evaluation of new guanidine-thiourea organocatalyst for the nitro-Michael reaction: Theoretical studies on mechanism and enantioselectivity

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Stefan Gussregen, Hans Matter, Gerhard Hessler, Marco Muller, Friedemann Schmidt, Tim Clark

3D-QSAR based on quantum-chemical molecular fields: toward an improved description of halogen interactions

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Christian R. Wick, Harald Lanig

, Christof M. Jager, Nicolai Burzlaff, Tim Clark

Structural insight into the Prolyl Hydroxylase PHD2: a molecular dynamics and DFT study

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Andrew J. Roering, Lillian V. A. Hale, Phillip A. Squier, Marissa A. Ringgold, Emily R. Wiederspan, Timothy B. Clark

Iridium-Catalyzed, Substrate-Directed C–H Borylation Reactions of Benzylic Amines

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Christian Kramer, Timothy Clark

New Types of Descriptors and Models in QSAR/QSPR

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Abdesselam Jedaa, Michael Salinas, Christof M. Jäger, Timothy Clark

, Alexander Ebel, Andreas Hirsch, Marcus Halik

Mixed self-assembled monolayer of molecules with dipolar and acceptor character—Influence on hysteresis and threshold voltage in organic thin-film transistors

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G. Ozpinar, Gül Altınbaş Özpınar, Frank R. Beierlein, Wolfgang Peukert

, Dirk Zahn, Tim Clark

A test of improved force field parameters for urea: molecular-dynamics simulations of urea crystals

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C. Meichsner, Tim Clark

, B. Groeppel, P. Groeppel, B. Winter, B. Butz, E. Spiecker

Formation of a protective layer during IEC(b) test of epoxy resin loaded with silica nanoparticles

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Tim Clark

σ-Holes

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Ahmed El Kerdawy

, A. Kerdawy, Christian R. Wick, Matthias Hennemann, Tim Clark

Predicting the sites and energies of noncovalent intermolecular interactions using local properties

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Michael Salinas, Christof M. Jager, Atefeh Y. Amin, Pavlo O. Dral

, Timo Meyer-Friedrichsen, Andreas Hirsch, Tim Clark

, Marcus Halik

The relationship between threshold voltage and dipolar character of self-assembled monolayers in organic thin-film transistors

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2011 Angela Goetz, Harald Lanig

, Peter Gmeiner

, Tim Clark

Molecular dynamics simulations of the effect of the G-protein and diffusible ligands on the β2-adrenergic receptor

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Matthias Hennemann, Jane S. Murray, Peter Politzer, Kevin E. Riley, Tim Clark

Polarization-induced σ-holes and hydrogen bonding

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Pavlo O. Dral

, Tim Clark

Semiempirical UNO–CAS and UNO–CI: method and applications in nanoelectronics

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This paper is made freely available by the publisher.

Karin Rosenlehner, Boris Schade, Christoph Böttcher, Christof M. Jäger, Timothy Clark

, Frank W. Heinemann, Andreas Hirsch

Corrigendum: Sodium Effect on Self-Organization of Amphiphilic Carboxylates: Formation of Structured Micelles and Superlattices

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Frank R. Beierlein, Geoff Kneale, Timothy Clark

Predicting the Effects of Basepair Mutations in DNA-Protein Complexes by Thermodynamic Integration

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Pavlo O. Dral

, Tatyana E. Shubina, Andreas Hirsch, Tim Clark

Influence of electron doping on the hydrogenation of fullerene C60: a theoretical investigation

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Markus Muehlbacher, Ahmed El Kerdawy

, Christian Kramer, Brian Hudson, Timothy Clark

Conformation-Dependent QSPR Models: logPOW

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Ian P. Query, Phillip A. Squier, Emily M. Larson, Nicholas A. Isley, Timothy B. Clark

Alkoxide-Catalyzed Reduction of Ketones with Pinacolborane

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Gustavo de Miguel

, Mateusz Wielopolski, David I. Schuster, Michael A. Fazio, Olivia P. Lee, Christopher K. Haley, Angy L. Ortiz, Luis Echegoyen, Timothy Clark

, Dirk M. Guldi

Triazole bridges as versatile linkers in electron donor-acceptor conjugates

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Papers authored by Timothy Clark