Torthaí cuardaigh - Jakub Rydzewski

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  1. 1
    Finding multiple reaction pathways of ligand unbinding

    Finding multiple reaction pathways of ligand unbinding de réir Jakub Rydzewski, Ómar Valsson

    Foilsithe / Cruthaithe 2019
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    Artigo
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  2. 2
    Multiscale Reweighted Stochastic Embedding: Deep Learning of Collective Variables for Enhanced Sampling

    Multiscale Reweighted Stochastic Embedding: Deep Learning of Collective Variables for Enhanced Sampling de réir Jakub Rydzewski, Ómar Valsson

    Foilsithe / Cruthaithe 2021
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  3. 3
    Machine learning of slow collective variables and enhanced sampling via spatial techniques

    Machine learning of slow collective variables and enhanced sampling via spatial techniques de réir Tuğçe Gökdemir, Jakub Rydzewski

    Foilsithe / Cruthaithe 2025
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  4. 4
    Promoting transparency and reproducibility in enhanced molecular simulations

    Promoting transparency and reproducibility in enhanced molecular simulations de réir Massimiliano Bonomi, Giovanni Bussi, Carlo Camilloni, Gareth A. Tribello, Pavel Banáš, Alessandro Barducci, Mattia Bernetti, Peter G. Bolhuis, Sandro Bottaro, Davide Branduardi, Riccardo Capelli, Paolo Carloni, Michele Ceriotti, Andrea Cesari, Haochuan Chen, Wei Chen, Francesco Colizzi, Sandip De, Marco De La Pierre, Davide Donadio, Viktor Drobot, Bernd Ensing, Andrew L. Ferguson, Marta Filizola, James S. Fraser, Haohao Fu, Piero Gasparotto, Francesco Luigi Gervasio, Federico Giberti, Alejandro Gil-Ley, Toni Giorgino, Gabriella T. Heller, Glen M. Hocky, Marcella Iannuzzi, Michele Invernizzi, Kim E. Jelfs, Alexander Jussupow, Evgeny Kirilin, Alessandro Laio, Vittorio Limongelli, Kresten Lindorff‐Larsen, Thomas Löhr, Fabrizio Marinelli, Layla Martin‐Samos, Matteo Masetti, Ralf Meyer, Angelos Michaelides, Carla Molteni, Tetsuya Morishita, Marco Nava, Cristina Paissoni, Elena Papaleo, Michele Parrinello, Jim Pfaendtner, Pablo M. Piaggi, GiovanniMaria Piccini, Adriana Pietropaolo, Fabio Pietrucci, Silvio Pipolo, Davide Provasi, David Quigley, Paolo Raiteri, Stefano Raniolo, Jakub Rydzewski, Matteo Salvalaglio, Gabriele C. Sosso, Vojtěch Spiwok, Jiřı́ Šponer, David W. Swenson, Pratyush Tiwary, Ómar Valsson, Michele Vendruscolo, Gregory A. Voth, Andrew Dickson White, The Plumed Consortium

    Foilsithe / Cruthaithe 2019
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