Searching for AChE inhibitors from natural compounds by using machine learning and atomistic simulations QM Thai, TNH Pham, DM Hiep, MQ Pham, PT Tran, TH Nguyen, ST Ngo Journal of Molecular Graphics and Modelling 115, 108230, 2022 | 8 | 2022 |
Lobaric acid prevents the adverse effects of tetramethrin on the estrous cycle of female albino Wistar rats HT Nguyen, H Polimati, SSP Annam, E Okello, QM Thai, TY Vu, ... Plos one 17 (7), e0269983, 2022 | 4 | 2022 |
Machine learning combines atomistic simulations to predict SARS-CoV-2 Mpro inhibitors from natural compounds TH Nguyen, QM Thai, MQ Pham, PTH Minh, HTT Phung Molecular Diversity 28 (2), 553-561, 2024 | 3 | 2024 |
Discovering Neuraminidase Inhibitors via Computational and Experimental Studies TH Nguyen, NQA Pham, QM Thai, VV Van, ST Ngo, JT Horng | | 2024 |
Natural compounds inhibit Monkeypox virus methyltransferase VP39 in silico studies QM Thai, HTT Phung, NQA Pham, JT Horng, PT Tran, NT Tung, ST Ngo Journal of Biomolecular Structure and Dynamics, 1-9, 2024 | | 2024 |
MedChemExpress compounds prevent neuraminidase N1 via physics-and knowledge-based methods QM Thai, TH Nguyen, HTT Phung, MQ Pham, NKT Pham, JT Horng, ... RSC advances 14 (27), 18950-18956, 2024 | | 2024 |
Alchemical approach performance in calculating the ligand-binding free energy ST Ngo, QM Thai, TH Nguyen, NN Tuan, TNH Pham, HTT Phung, ... RSC advances 14 (21), 14875-14885, 2024 | | 2024 |
Silver nanoparticles alter the dimerization of Aβ 42 studied by REMD simulations QM Thai, PT Tran, HTT Phung, MQ Pham, ST Ngo RSC advances 14 (21), 15112-15119, 2024 | | 2024 |