Nonadiabatic excited-state intramolecular proton transfer in 3-hydroxyflavone: S2 state involvement via multi-mode effect von Anand, Neethu, Welke, Kai, Irle, Stephan, Vennapusa, Sivaranjana Reddy

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New QM/MM implementation of the DFTB3 method in the gromacs package von Kubař, Tomáš, Welke, Kai, Groenhof, Gerrit

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Multiscale Simulations on Charge Transport in Covalent Organic Frameworks Including Dynamics of Transfer Integrals from the FMO-DFTB/LCMO Approach von Kitoh-Nishioka, Hirotaka, Welke, Kai, Nishimoto, Yoshio, Fedorov, Dmitri G, Irle, Stephan

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Towards an Understanding of Channelrhodopsin Function: Simulations Lead to Novel Insights of the Channel Mechanism von Watanabe, Hiroshi C., Welke, Kai, Sindhikara, Daniel J., Hegemann, Peter, Elstner, Marcus

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Cryptic bioactivity capacitated by synthetic hybrid plant peptides von Hirakawa, Yuki, Shinohara, Hidefumi, Welke, Kai, Irle, Stephan, Matsubayashi, Yoshikatsu, Torii, Keiko U., Uchida, Naoyuki

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QM/MM simulations of vibrational spectra of bacteriorhodopsin and channelrhodopsin-2 von WELKE, Kai, WATANABE, Hiroshi C, WOLTER, Tino, GAUS, Michael, ELSTNER, Marcus

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Excitation energies of a water-bridged twisted retinal structure in the bacteriorhodopsin proton pump: a theoretical investigation von WOLTER, Tino, WELKE, Kai, PHATAK, Prasad, BONDAR, Ana-Nicoleta, ELSTNER, Marcus

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Color Tuning in Binding Pocket Models of the Chlamydomonas-Type Channelrhodopsins von Welke, Kai, Frähmcke, Jan S, Watanabe, Hiroshi C, Hegemann, Peter, Elstner, Marcus

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Fragment Orbital Based Description of Charge Transfer in Peptides Including Backbone Orbitals von Heck, Alexander, Woiczikowski, P. Benjamin, Kubař, Tomáš, Welke, Kai, Niehaus, Thomas, Giese, Bernd, Skourtis, Spiros, Elstner, Marcus, Steinbrecher, Thomas B

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Nonadiabatic excited-state intramolecular proton transfer in 3-hydroxyflavone: S 2 state involvement via multi-mode effect von Anand, Neethu, Welke, Kai, Irle, Stephan, Vennapusa, Sivaranjana Reddy

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Freezing, melting and structure of ice in a hydrophilic nanopore von MOORE, Emily B, DE LA LLAVE, Ezequiel, WELKE, Kai, SCHERLIS, Damian A, MOLINERO, Valeria

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A Macrocyclic Fluorophore Dimer with Flexible Linkers: Bright Excimer Emission with a Long Fluorescence Lifetime von Osaki, Hiroshi, Chou, Chih-Ming, Taki, Masayasu, Welke, Kai, Yokogawa, Daisuke, Irle, Stephan, Sato, Yoshikatsu, Higashiyama, Tetsuya, Saito, Shohei, Fukazawa, Aiko, Yamaguchi, Shigehiro

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Structural Model of Channelrhodopsin von Watanabe, Hiroshi C., Welke, Kai, Schneider, Franziska, Tsunoda, Satoshi, Zhang, Feng, Deisseroth, Karl, Hegemann, Peter, Elstner, Marcus

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Excitation energies of a water-bridged twisted retinal structure in the bacteriorhodopsin proton pump: a theoretical investigationElectronic upplementary information (ESI) availabl... von Wolter, Tino, Welke, Kai, Phatak, Prasad, Bondar, Ana-Nicoleta, Elstner, Marcus

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QM/MM simulations of vibrational spectra of bacteriorhodopsin and channelrhodopsin-2Electronic supplementary information (ESI) available: Detailed benchmark of DFTB performance wit... von Welke, Kai, Watanabe, Hiroshi C, Wolter, Tino, Gaus, Michael, Elstner, Marcus

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ARMAR-III: Advances in Humanoid Grasping and Manipulation von Asfour, Tamim, Vahrenkamp, Nikolaus, Schiebener, David, Do, Martin, Przybylski, Markus, Welke, Kai, Schill, Julian, Dillmann, Rüdiger

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A Macrocyclic Fluorophore Dimer with Flexible Linkers: Bright Excimer Emission with a Long Fluorescence Lifetime von Osaki, Hiroshi, Chou, Chih-Ming, Taki, Masayasu, Welke, Kai, Yokogawa, Daisuke, Irle, Stephan, Sato, Yoshikatsu, Higashiyama, Tetsuya, Saito, Shohei, Fukazawa, Aiko, Yamaguchi, Shigehiro

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Unconstrained Real-time Markerless Hand Tracking for Humanoid Interaction von Gumpp, T., Azad, P., Welke, K., Oztop, E., Dillmann, R., Cheng, G.

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Exploiting similarities for robot perception von Welke, K., Oztop, E., Cheng, G., Dillmann, R.

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The Karlsruhe Humanoid Head von Asfour, T., Welke, K., Azad, P., Ude, A., Dillmann, R.

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