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

MDIntrinsicDimension: Dimensionality-Based Analysis of Collective Motions in Macromolecules from Molecular Dynamics Trajectories

MDIntrinsicDimension:基于维度分析大分子分子动力学轨迹中的集体运动

Cazzaniga, Irene; Giorgino, Toni

Large scale investigation of GPCR molecular dynamics data uncovers allosteric sites and lateral gateways

对GPCR分子动力学数据的大规模研究揭示了变构位点和侧向通道

Aranda-García, David; Stepniewski, Tomasz Maciej; Torrens-Fontanals, Mariona; García-Recio, Adrian; Lopez-Balastegui, Marta; Medel-Lacruz, Brian; Morales-Pastor, Adrián; Peralta-García, Alejandro; Dieguez-Eceolaza, Miguel; Sotillo-Nuñez, David; Ding, Tianyi; Drabek, Matthäus; Jacquemard, Célien; Jakowiecki, Jakub; Jespers, Willem; Jiménez-Rosés, Mireia; Jun-Yu-Lim, Víctor; Nicoli, Alessandro; Orzel, Urszula; Shahraki, Aida; Tiemann, Johanna K S; Ledesma-Martin, Vicente; Nerín-Fonz, Francho; Suárez-Dou, Sergio; Canal, Oriol; Pándy-Szekeres, Gáspár; Mao, Jiafei; Gloriam, David E; Kellenberger, Esther; Latek, Dorota; Guixà-González, Ramon; Gutiérrez-de-Terán, Hugo; Tikhonova, Irina G; Hildebrand, Peter W; Filizola, Marta; Babu, M Madan; Di Pizio, Antonella; Filipek, Slawomir; Kolb, Peter; Cordomi, Arnau; Giorgino, Toni; Marti-Solano, Maria; Selent, Jana

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

mdCATH: A Large-Scale MD Dataset for Data-Driven Computational Biophysics

mdCATH:用于数据驱动计算生物物理学的大规模分子动力学数据集

Mirarchi, Antonio; Giorgino, Toni; De Fabritiis, Gianni

The antipsychotic drug lurasidone inhibits coronaviruses by affecting multiple targets.

抗精神病药物鲁拉西酮通过影响多个靶点来抑制冠状病毒

Baroni Sara, Carletti Tea, Donalisio Manuela, Arduino Irene, Cazzaniga Irene, Giorgino Toni, Esposito Francesca, Porta Alessia, Diomede Luisa, De Luigi Ada, Gobbi Marco, Lembo David, Marcello Alessandro, Tramontano Enzo, Milani Mario, Mastrangelo Eloise

AlloViz: A tool for the calculation and visualisation of protein allosteric communication networks

AlloViz:用于计算和可视化蛋白质变构通讯网络的工具

Nerín-Fonz, Francho; Caprai, Camilla; Morales-Pastor, Adrián; Lopez-Balastegui, Marta; Aranda-García, David; Giorgino, Toni; Selent, Jana

Machine learning coarse-grained potentials of protein thermodynamics

机器学习粗粒化蛋白质热力学势

Majewski, Maciej; Pérez, Adrià; Thölke, Philipp; Doerr, Stefan; Charron, Nicholas E; Giorgino, Toni; Husic, Brooke E; Clementi, Cecilia; Noé, Frank; De Fabritiis, Gianni

Maternal immune activation leads to defective brain blood vessels and intracerebral hemorrhages in male offspring

母体免疫激活会导致雄性后代脑血管缺陷和脑出血

Rasile, Marco; Lauranzano, Eliana; Faggiani, Elisa; Ravanelli, Margherita M; Colombo, Federico S; Mirabella, Filippo; Corradini, Irene; Malosio, Maria L; Borreca, Antonella; Focchi, Elisa; Pozzi, Davide; Giorgino, Toni; Barajon, Isabella; Matteoli, Michela

SCoV2-MD: a database for the dynamics of the SARS-CoV-2 proteome and variant impact predictions

SCoV2-MD:SARS-CoV-2 蛋白质组动态变化及变异株影响预测数据库

Torrens-Fontanals, Mariona; Peralta-García, Alejandro; Talarico, Carmine; Guixà-González, Ramon; Giorgino, Toni; Selent, Jana

A prognostic model to predict survival after 6 months of ruxolitinib in patients with myelofibrosis

预测骨髓纤维化患者接受鲁索替尼治疗6个月后生存率的预后模型

Maffioli, Margherita; Mora, Barbara; Ball, Somedeb; Iurlo, Alessandra; Elli, Elena Maria; Finazzi, Maria Chiara; Polverelli, Nicola; Rumi, Elisa; Caramella, Marianna; Carraro, Maria Cristina; D'Adda, Mariella; Molteni, Alfredo; Sissa, Cinzia; Lunghi, Francesca; Vismara, Alessandro; Ubezio, Marta; Guidetti, Anna; Caberlon, Sabrina; Anghilieri, Michela; Komrokji, Rami; Cattaneo, Daniele; Della Porta, Matteo Giovanni; Giorgino, Toni; Bertù, Lorenza; Brociner, Marco; Kuykendall, Andrew; Passamonti, Francesco