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Issue Date | Title | Author(s) |
---|---|---|
7-Dec-2016 | The Role of Unconventional Hydrogen Bonds in Determining BII Propensities in B-DNA | Balaceanu, Alexandra; Pasi, Marco; Dans, Pablo D.; Hospital Gasch, Adam; Lavery, Richard; Orozco López, Modesto |
27-Mar-2015 | Molecular dynamics study of natural existing cavity couplings in proteins | Barbany, Montserrat; Meyer, Tim; Hospital Gasch, Adam; Faustino Pló, Ignacio; D´Abramo, Marco; Morata Chirivella, Jordi; Orozco López, Modesto; Cruz, Xavier de la |
14-Jan-2017 | How accurate are accurate force-fields for B-DNA? | Dans, Pablo D.; Ivani, Ivan; Hospital Gasch, Adam; Portella, Guillem; González, Carlos; Orozco López, Modesto |
6-Jan-2017 | The multiple roles of waters in protein solvation | Hospital Gasch, Adam; Candotti, Michela; Gelpí Buchaca, Josep Lluís; Orozco López, Modesto |
25-Jan-2019 | Predicting the Limit of Intramolecular Hydrogen Bonding with Classical Molecular Dynamics | Colizzi, Francesco; Hospital Gasch, Adam; Zivanovic, Sanja; Orozco López, Modesto |
1-Jan-2023 | A new paradigm for molecular dynamics databases: the COVID-19 database, the legacy of a titanic community effort | Beltrán, Daniel; Hospital Gasch, Adam; Gelpí Buchaca, Josep Lluís; Orozco López, Modesto |
28-Aug-2020 | DFFR: A New Method for High-Throughput Recalibration of Automatic Force-Fields for Drugs | Moreno, David; Zivanovic, Sanja; Colizzi, Francesco; Hospital Gasch, Adam; Aranda, Juan; Soliva, Robert; Orozco López, Modesto |