Author: "Mirko Paulikat" / Journal: j. chem. inf. model. - Searchworks@Jio Institute Digital Library Search Results

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Your search keyword '"Mirko Paulikat"' showing total 3 results

Start Over Author "Mirko Paulikat" Journal j. chem. inf. model.

3 results on '"Mirko Paulikat"'

1. Molecular Dynamics and Structural Studies of Zinc Chloroquine Complexes.

Author: Mirko Paulikat, Daniele Vitone, Florian Karl Schackert, Nils Schuth, Alessandra Barbanente, GiovanniMaria Piccini, Emiliano Ippoliti, Giulia Rossetti, Adam H. Clark, Maarten Nachtegaal, Michael Haumann, Holger Dau, Paolo Carloni, Silvano Geremia, Rita De Zorzi, Liliana Quintanar, and Fabio Arnesano
Published: 2023
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2. Drug Design in the Exascale Era: A Perspective from Massively Parallel QM/MM Simulations.

Author: Bharath Raghavan, Mirko Paulikat, Katya Ahmad, Lara Callea, Andrea Rizzi, Emiliano Ippoliti, Davide Mandelli, Laura Bonati, Marco de Vivo, and Paolo Carloni
Published: 2023
Full Text: View/download PDF

3. Physical Chemistry of Chloroquine Permeation through the Cell Membrane with Atomistic Detail.

Author: Mirko Paulikat, GiovanniMaria Piccini, Emiliano Ippoliti, Giulia Rossetti, Fabio Arnesano, and Paolo Carloni
Published: 2023
Full Text: View/download PDF

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