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A

Andrea R. Beccari

Dompé Farmaceutici S.P.A.

28H指数
158论文数
3.0K被引数
收录论文 46
发表时间
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XenoSoM: A deep learning framework for site of metabolism prediction of xenobioticsXenoSoM：一种用于预测外源性物质代谢位点的深度学习框架
errEuropean Journal of Medicinal Chemistry
IF5.9
err2026-09-07
err0
PREAI
errAlessio Macorano; Serena Vittorio; Filippo Lunghini; Alessandro Pedretti; Giulio Vistoli; Andrea Rosario Beccari
err分享
err收藏
Dissecting the binding landscape of four cKIT inhibitors through an integrated multifaceted approach通过集成多层面方法解析四种cKIT抑制剂的结合景观
errInternational Journal of Biological Macromolecules
IF8.5
err2026-08-24
err0
errOAAI
errIrene Cipollone; Carmen Gratteri; Carmine Talarico; Andrea Rosario Beccari; Dedna Zoubri; Alexandre Baron; Vanessa Porkolab; Daniela Iaconis; Maria Monti
err分享
err收藏
Molecular Dynamics Workflows to Compute Large-Scale Sets of Absolute Binding Free Energies Aiding Drug Candidate and Binding Pose Selection分子动力学工作流程用于计算大规模绝对结合自由能集，以辅助药物候选物和结合构象的选择
errJournal of Chemical Theory and Computation
IF5.5
err2026-05-13
err0
errOAAI
errSebastian Wingbermühle; Akash Deep Biswas; Domenico Bonanni; Tatiana Shugaeva; Davide Gadioli; Jakub Beránek; Giorgia Frumenzio; Lara Querciagrossa; Andrea Piserchia; Gianmarco Accordi; Filippo Lunghini; Carmine Talarico; Andrew Emerson; Jan Martinovič; Andrea Rosario Beccari; Gianluca Palermo; Erik Lindahl
err分享
err收藏
ProfhEX: Empowering Early Drug Discovery with Machine Learning-Based Target Profiling and Liability Prediction
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2025-12-01
err0
PREAI
errLunghini, Filippo; Cerchia, Carmen; Fava, Anna; Pisapia, Vincenzo; Sacco, Francesco; Beccari, Andrea Rosario
err分享
err收藏
Condensation of Force Field Parameters from Machine Learning Predicted Distributions for High-Throughput Virtual Screening Applications基于机器学习预测分布的力场参数凝聚：高通量虚拟筛选应用
errJournal of Chemical Information and Modeling
IF5.3
err2025-11-21
err0
errOAAI
errDomenico Bonanni; Yuedong Zhang; Davide Gadioli; Gianluca Scarpellini; Pietro Morerio; Alessio Del Bue; Andrea Rosario Beccari; Gianluca Palermo
err分享
err收藏
SARS-CoV-2 Entry Can Be Mimicked in C. elegans Expressing Human ACE2: A New Tool for Pharmacological StudiesSARS-CoV-2的入侵可以被模拟在表达人源ACE2的秀丽隐杆线虫中：一种用于药理学研究的新工具
errViruses 2025, Vol. 17, Page 1387
IF0
err2025-10-18
err0
errOAAI
errMargherita Romeo; Sara Baroni; Maria Monica Barzago; Samuela Gambini; Ada De Luigi; Daniela Iaconis; Andrea Rosario Beccari; Maddalena Fratelli; Luisa Diomede
err分享
err收藏
Prediction of UGT-mediated phase II metabolism via ligand- and structure-based predictive models通过配体和结构为基础的预测模型对UGT介导的II相代谢进行预测
errJournal of Cheminformatics
IF5.7
err2025-10-17
err0
errOAAI
errLudovica Bono; Filippo Lunghini; Emanuela Sabato; Akash Deep Biswas; Angelica Mazzolari; Alessandro Pedretti; Andrea R. Beccari; Giulio Vistoli; Serena Vittorio
err分享
err收藏
Molecular docking via weighted subgraph isomorphism on quantum annealers基于加权子图同构的量子退火分子对接
errQuantum Science and Technology
IF5
err2025-09-30
err0
PREAI
errEmanuele Triuzzi; Riccardo Mengoni; Francesco Micucci; Domenico Bonanni; Daniele Ottaviani; Andrea Rosario Beccari; Gianluca Palermo
err分享
err收藏
Transformation of a Potent C9-Substituted Phenylmorphan into MOR Partial Agonists with Improvement of Metabolic Stability: An In Vitro, In Vivo, and In Silico Study将一种强效C9-取代的苯基吗喃转化为MOR部分激动剂并提高代谢稳定性：一项体外、体内和计算机模拟研究
errACS CHEMICAL NEUROSCIENCE
IF3.9
err2025-05-20
err0
PREAI
errHernandez, Delmis E.; Luo, Dan; Prisinzano, Thomas E.; Negus, S. Stevens; Nassehi, Nima; Selley, Dana E.; Shah, Pranav; Kato, Rintaro; Xu, Xin; Talarico, Carmine; Graziani, Davide; Beccari, Andrea R.; Jacobson, Arthur E.; Rice, Kenner C.; Sulima, Agnieszka
err分享
err收藏
Integrating Surface Plasmon Resonance and Docking Analysis for Mechanistic Insights of Tryptase Inhibitors
errMOLECULES
IF4.6
err2025-03-17
err0
errOAAI
errPorta, Alessia; Manelfi, Candida; Talarico, Carmine; Beccari, Andrea Rosario; Brindisi, Margherita; Summa, Vincenzo; Iaconis, Daniela; Gobbi, Marco; Beeg, Marten
err分享
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Enabling performance portability on the LiGen drug discovery pipeline
errFUTURE GENERATION COMPUTER SYSTEMS-THE INTERNATIONAL JOURNAL OF ESCIENCE
IF6.1
err2024-09-01
err0
errOAAI
errCrisci, Luigi; Carpentieri, Lorenzo; Cosenza, Biagio; Accordi, Gianmarco; Gadioli, Davide; Vitali, Emanuele; Palermo, Gianluca; Beccari, Andrea Rosario
err分享
err收藏
Identification and characterization of a new potent inhibitor targeting CtBP1/BARS in melanoma cells
errJOURNAL OF EXPERIMENTAL & CLINICAL CANCER RESEARCH
IF12.8
err2024-05-06
err1
errOAAI
errFilograna, Angela; De Tito, Stefano; Monte, Matteo Lo; Oliva, Rosario; Bruzzese, Francesca; Roca, Maria Serena; Zannetti, Antonella; Greco, Adelaide; Spano, Daniela; Ayala, Inmaculada; Liberti, Assunta; Petraccone, Luigi; Dathan, Nina; Catara, Giuliana; Schembri, Laura; Colanzi, Antonino; Budillon, Alfredo; Beccari, Andrea Rosario; Del Vecchio, Pompea; Luini, Alberto; Corda, Daniela; Valente, Carmen
err分享
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GPU-optimized approaches to molecular docking-based virtual screening in drug discovery: A comparative analysisGPU优化的基于分子对接的药物发现虚拟筛选方法: 比较分析
errJOURNAL OF PARALLEL AND DISTRIBUTED COMPUTING
IF4
err2024-04-01
err5
errOAAI
errVitali, Emanuele; Ficarelli, Federico; Bisson, Mauro; Gadioli, Davide; Accordi, Gianmarco; Fatica, Massimiliano; Beccari, Andrea R.; Palermo, Gianluca
err分享
err收藏
DompeKeys: a set of novel substructure-based descriptors for efficient chemical space mapping, development and structural interpretation of machine learning models, and indexing of large databases
errJOURNAL OF CHEMINFORMATICS
IF5.7
err2024-02-23
err0
errOAAI
errManelfi, Candida; Tazzari, Valerio; Lunghini, Filippo; Cerchia, Carmen; Fava, Anna; Pedretti, Alessandro; Stouten, Pieter F. W.; Vistoli, Giulio; Beccari, Andrea Rosario
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err收藏
Structure of human TRPM8 channel
errCOMMUNICATIONS BIOLOGY
IF5.1
err2023-10-19
err6
errOAAI
errPalchevskyi, Sergii; Czarnocki-Cieciura, Mariusz; Vistoli, Giulio; Gervasoni, Silvia; Nowak, Elzbieta; Beccari, Andrea R.; Nowotny, Marcin; Talarico, Carmine
err分享
err收藏
A non-intrusive data-driven reduced order model for parametrized CFD-DEM numerical simulations用于参数化cfd-dem数值模拟的非侵入式数据驱动的降阶模型
errJOURNAL OF COMPUTATIONAL PHYSICS
IF3.8
err2023-10-01
err17
errOAAI
errHajisharifi, Arash; Romano, Francesco; Girfoglio, Michele; Beccari, Andrea; Bonanni, Domenico; Rozza, Gianluigi
err分享
err收藏
MEDIATE-Molecular DockIng at homE: Turning collaborative simulations into therapeutic solutions
errEXPERT OPINION ON DRUG DISCOVERY
IF4.9
err2023-07-10
err6
errOAAI
errVistoli, Giulio; Manelfi, Candida; Talarico, Carmine; Fava, Anna; Warshel, Arieh; Tetko, Igor V.; Apostolov, Rossen; Ye, Yang; Latini, Chiara; Ficarelli, Federico; Palermo, Gianluca; Gadioli, Davide; Vitali, Emanuele; Varriale, Gaetano; Pisapia, Vincenzo; Scaturro, Marco; Coletti, Silvano; Gregori, Daniele; Gruffat, Daniel; Leija, Edgardo; Hessenauer, Sam; Delbianco, Alberto; Allegretti, Marcello; Beccari, Andrea R.
err分享
err收藏
ProfhEX: AI-based platform for small molecules liability profiling
errJOURNAL OF CHEMINFORMATICS
IF5.7
err2023-06-09
err4
errOAAI
errLunghini, Filippo; Fava, Anna; Pisapia, Vincenzo; Sacco, Francesco; Iaconis, Daniela; Beccari, Andrea Rosario
err分享
err收藏
A Deep Learning Approach to Optimize Recombinant Protein Production in Escherichia coli Fermentations
errFERMENTATION-BASEL
IF3.3
err2023-05-24
err1
errOAAI
errBonanni, Domenico; Litrico, Mattia; Ahmed, Waqar; Morerio, Pietro; Cazzorla, Tiziano; Spaccapaniccia, Elisa; Cattani, Franca; Allegretti, Marcello; Beccari, Andrea Rosario; Del Bue, Alessio; Martin, Franck
err分享
err收藏
DHFR Inhibitors Display a Pleiotropic Anti-Viral Activity against SARS-CoV-2: Insights into the Mechanisms of Action
errVIRUSES-BASEL
IF3.5
err2023-05-09
err5
errOAAI
errIaconis, Daniela; Caccuri, Francesca; Manelfi, Candida; Talarico, Carmine; Bugatti, Antonella; Filippini, Federica; Zani, Alberto; Novelli, Rubina; Kuzikov, Maria; Ellinger, Bernhard; Gribbon, Philip; Riecken, Kristoffer; Esposito, Francesca; Corona, Angela; Tramontano, Enzo; Beccari, Andrea Rosario; Caruso, Arnaldo; Allegretti, Marcello
err分享
err收藏

研究方向

暂无研究方向
合作学者
合作期刊
A
Arieh Warshel
H 指数: 123 · 论文数: 594
A
Alberto Luini
H 指数: 111 · 论文数: 643
M
Mauro Martins Teixeira
H 指数: 106 · 论文数: 1.1K
F
Fernando Q. Cunha
H 指数: 103 · 论文数: 1.1K
M
Martin G. Pomper
H 指数: 101 · 论文数: 1.0K
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