首页> International journal of molecular sciences> Artificial Intelligence-Powered Molecular Docking and Steered Molecular Dynamics for Accurate scFv Selection of Anti-CD30 Chimeric Antigen Receptors.

Artificial Intelligence-Powered Molecular Docking and Steered Molecular Dynamics for Accurate scFv Selection of Anti-CD30 Chimeric Antigen Receptors.

导出 OA

翻译打印收藏纠错

第一作者： Nico,Martarelli

第一单位： Institute of Hematology and Center for Hemato-Oncology Research, University of Perugia and Santa Maria della Misericordia Hospital, 06132 Perugia, Italy.

作者： Nico,Martarelli ^[1] ; Michela,Capurro ^[1] ; Gizem,Mansour ^[2] ; Ramina Vossoughi,Jahromi ^[1] ; Arianna,Stella ^[1] ; Roberta,Rossi ^[1] ; Emanuele,Longetti ^[1] ; Barbara,Bigerna ^[1] ; Marco,Gentili ^[1] ; Ariele,Rosseto ^[1] ; Riccardo,Rossi ^[1] ; Chiara,Cencini ^[3] ; Carla,Emiliani ^[3] ; Sabata,Martino ^[3] ; Marten,Beeg ^[2] ; Marco,Gobbi ^[2] ; Enrico,Tiacci ^[1] ; Brunangelo,Falini ^[1] ; Francesco,Morena ^[3] ; Vincenzo Maria,Perriello ^[1]

作者单位： Institute of Hematology and Center for Hemato-Oncology Research, University of Perugia and Santa Maria della Misericordia Hospital, 06132 Perugia, Italy. ^[1] Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via Mario Negri 2, 20156 Milano, Italy. ^[2] Department of Chemistry, Biology, and Biotechnologies, Via del Giochetto, University of Perugia, 06122 Perugia, Italy. ^[3]

关键词 CD30 Hodgkin’s lymphoma artificial intelligence (AI)chimeric antigen T cells (CAR-T)coarse grained umbrella sampling (CG-US)molecular docking (MD)steered molecular dynamics (SMD)