"AI Promoted Virtual Screening, Structure-Based Hit Optimization, and ..."

Ioannis Gkekas et al. (2024)

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DOI: 10.1021/ACS.JCIM.4C01110

access: closed

type: Journal Article

metadata version: 2025-01-08

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Ioannis Gkekas, Sotiris Katsamakas, Stelios K. Mylonas, Theano Fotopoulou, George Epsilon. Magoulas, Alia Cristina Tenchiu, Marios Dimitriou, Apostolos Axenopoulos, Nafsika Rossopoulou, Simona Kostova, Erich E. Wanker, Theodora Katsila, Demetris Papahatjis, Vassilis G. Gorgoulis, Maria Koufaki, Ioannis Karakasiliotis, Theodora Calogeropoulou, Petros Daras, Spyros Petrakis:
AI Promoted Virtual Screening, Structure-Based Hit Optimization, and Synthesis of Novel COVID-19 S-RBD Domain Inhibitors. J. Chem. Inf. Model. 64(22): 8562-8585 (2024)

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