Computer-Chemie-Centrum (CCC)

Understanding and Controlling Short- A nd Long-Range Electron/Charge-Transfer Processes in Electron Donor-Acceptor Conjugates (2020) Kaur R, Possanza F, Limosani F, Bauroth S, Zanoni R, Clark T, Arrigoni G, et al. Journal article Regioselective convergent synthesis of 2-arylidene thiazolo[3,2-: A] pyrimidines as potential anti-chikungunya agents (2020) Fares M, McCosker PM, Alsherbiny MA, Willis AC, Clark T, Neyts J, Jochmans D, Keller PA Journal article Singlet Fission in Pyrene-Fused Azaacene Dimers (2019) Mora-Fuentes JP, Papadopoulos I, Thiel D, Alvarez-Boto R, Cortizo-Lacalle D, Clark T, Melle-Franco M, et al. Journal article Basal Histamine H-4 Receptor Activation: Agonist Mimicry by the Diphenylalanine Motif (2019) Wifling D, Pfleger C, Kaindl J, Ibrahim P, Kling R, Buschauert A, Gohlke H, Clark T Journal article Combining Zinc Phthalocyanines, Oligo(p-Phenylenevinylenes), and Fullerenes to Impact Reorganization Energies and Attenuation Factors (2019) Krug M, Stangel C, Zieleniewska A, Clark T, Torres T, Coutsolelos AG, Guldi DM Journal article Synthesis and density functional theory studies of azirinyl and oxiranyl functionalized isoindigo and (3Z,3′Z)-3,3′-(ethane-1,2-diylidene)bis(indolin-2-one) derivatives (2019) Khalili G, McCosker PM, Clark T, Keller PA Journal article Universal Activation Index for Class A GPCRs (2019) Ibrahim P, Wifling D, Clark T Journal article Chromophore Multiplication To Enable Exciton Delocalization and Triplet Diffusion Following Singlet Fission in Tetrameric Pentacene (2019) Hetzer C, Basel B, Kopp SM, Hampel F, White FJ, Clark T, Guldi DM, Tykwinski RR Journal article Opposing Electronic and Nuclear Quantum Effects on Hydrogen Bonds in H2O and D2O (2019) Clark T, Heske J, Kühne TD Journal article Correction to: The Feynman dispersion correction for MNDO extended to F, Cl, Br and I (Journal of Molecular Modeling, (2019), 25, 6, (156), 10.1007/s00894-019-4038-z) (2019) Kriebel M, Heßelmann A, Hennemann M, Clark T Journal article, Erratum