Ly Le
Ly Le
Associate Professor, School of Biotechnology, International University, Vietnam National University
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Nanophase segregation in supercooled aqueous solutions and their glasses driven by the polyamorphism of water
L Le, V Molinero
The Journal of Physical Chemistry A 115 (23), 5900-5907, 2011
Molecular dynamics simulations suggest that electrostatic funnel directs binding of Tamiflu to influenza N1 neuraminidases
L Le, EH Lee, DJ Hardy, TN Truong, K Schulten
PLoS Comput Biol 6 (9), e1000939, 2010
Molecular modeling of swine influenza A/H1N1, Spanish H1N1, and avian H5N1 flu N1 neuraminidases bound to Tamiflu and Relenza
L Le, E Lee, T Truong, K Schulten
PLoS currents 1, 2009
Discovery of potential M2 channel inhibitors based on the amantadine scaffold via virtual screening and pharmacophore modeling
L Tran, SB Choi, BO Al-Najjar, M Yusuf, HA Wahab, L Le
Molecules 16 (12), 10227-10255, 2011
Structure, bonding, and solvation of lithium vinylcarbenoids
LM Pratt, NV Nguỹn, LT L
The Journal of Organic Chemistry 70 (6), 2294-2298, 2005
Data-driven approach to detect and predict adverse drug reactions
TB Ho, L Le, DT Thai, S Taewijit
Current pharmaceutical design 22 (23), 3498-3526, 2016
Steered molecular dynamics simulation in rational drug design
PC Do, EH Lee, L Le
Journal of Chemical Information and Modeling 58 (8), 1473-1482, 2018
Determination of structural requirements of influenza neuraminidase type A inhibitors and binding interaction analysis with the active site of A/H1N1 by 3D-QSAR CoMFA and…
PR Murumkar, L Le, TN Truong, MR Yadav
MedChemComm 2 (8), 710-719, 2011
Targeted proteins for diabetes drug design
NDT Nguyen, LT Le
Advances in Natural Sciences: Nanoscience and Nanotechnology 3 (1), 013001, 2012
Explicitly solvated ligand contribution to continuum solvation models for binding free energies: selectivity of theophylline binding to an RNA aptamer
H Freedman, LP Huynh, L Le, TE Cheatham III, JA Tuszynski, TN Truong
The Journal of Physical Chemistry B 114 (6), 2227-2237, 2010
Study on phylogenetic relationships, variability, and correlated mutations in M2 proteins of influenza virus A
L Le, J Leluk
PloS one 6 (8), e22970, 2011
Steered molecular dynamics approach for promising drugs for influenza A virus targeting M2 channel proteins
H Nguyen, L Le
European Biophysics Journal 44 (6), 447-455, 2015
A new piece in the puzzle of the novel avian-origin influenza A (H7N9) virus
RTC Lee, V Gunalan, TD Van, LT Le, F Eisenhaber, S Maurer-Stroh
Biology direct 8 (1), 1-5, 2013
Systems pharmacology: A unified framework for prediction of drug-target interactions
DH Le, L Le
Current pharmaceutical design 22 (23), 3569-3575, 2016
A computational study of mixed aggregates of chloromethyllithium with lithium dialkylamides
LM Pratt, LT L, TN Truong
The Journal of organic chemistry 70 (21), 8298-8302, 2005
Top-hits for H1N1pdm identified by virtual screening using ensemble-based docking
H Nguyen, L Le, TN Truong
PLoS currents 3, 2009
Improving the Performance of the Coupled Reference Interaction Site Model− Hyper-netted Chain (RISM− HNC)/Simulation Method for Free Energy of Solvation
H Freedman, L Le, JA Tuszynski, TN Truong
The Journal of Physical Chemistry B 112 (8), 2340-2348, 2008
Computational study of drug binding affinity to influenza A Neuraminidase using smooth reaction path generation (SRPG) method
H Nguyen, T Tran, Y Fukunishi, J Higo, H Nakamura, L Le
Journal of chemical information and modeling 55 (9), 1936-1943, 2015
Identification of novel compounds against an R294K substitution of influenza A (H7N9) virus using ensemble based drug virtual screening
TV Nhut Tran, H Nguyen, L Le
International journal of medical sciences 12 (2), 163, 2015
Hydrosoluble Benzo[e]pyridoindolones as Potent Inhibitors of Aurora Kinases
LTT Le, HL Vu, D Naud‐Martin, M Bombled, CH Nguyen, A Molla
ChemMedChem 8 (2), 289-296, 2013
Il sistema al momento non pu eseguire l'operazione. Riprova pi tardi.
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