日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

PLUMED Tutorials: A collaborative, community-driven learning ecosystem

PLUMED教程:一个协作式、社区驱动的学习生态系统

Tribello, Gareth A; Bonomi, Massimiliano; Bussi, Giovanni; Camilloni, Carlo; Armstrong, Blake I; Arsiccio, Andrea; Aureli, Simone; Ballabio, Federico; Bernetti, Mattia; Bonati, Luigi; Brookes, Samuel G H; Brotzakis, Z Faidon; Capelli, Riccardo; Ceriotti, Michele; Chan, Kam-Tung; Cossio, Pilar; Dasetty, Siva; Donadio, Davide; Ensing, Bernd; Ferguson, Andrew L; Fraux, Guillaume; Gale, Julian D; Gervasio, Francesco Luigi; Giorgino, Toni; Herringer, Nicholas S M; Hocky, Glen M; Hoff, Samuel E; Invernizzi, Michele; Languin-Cattoën, Olivier; Leone, Vanessa; Limongelli, Vittorio; Lopez-Acevedo, Olga; Marinelli, Fabrizio; Febrer Martinez, Pedro; Masetti, Matteo; Mehdi, Shams; Michaelides, Angelos; Murtada, Mhd Hussein; Parrinello, Michele; Piaggi, Pablo M; Pietropaolo, Adriana; Pietrucci, Fabio; Pipolo, Silvio; Pritchard, Claire; Raiteri, Paolo; Raniolo, Stefano; Rapetti, Daniele; Rizzi, Valerio; Rydzewski, Jakub; Salvalaglio, Matteo; Schran, Christoph; Seal, Aniruddha; Shayesteh Zadeh, Armin; Silva, Tomás F D; Spiwok, Vojtěch; Stirnemann, Guillaume; Sucerquia, Daniel; Tiwary, Pratyush; Valsson, Omar; Vendruscolo, Michele; Voth, Gregory A; White, Andrew D; Wu, Jiangbo

Host-Guest Binding Free Energies à la Carte: An Automated OneOPES Protocol

主机-客体结合自由能按需选择:一种自动化的 OneOPES 协议

Febrer Martinez, Pedro; Rizzi, Valerio; Aureli, Simone; Gervasio, Francesco Luigi