| 1 |
Effect of ligand torsion number on the AutoDock mediated prediction of protein-ligand binding affinity
Sriramulu DK, Wu SW, Lee SG
Journal of Industrial and Engineering Chemistry, 83, 359, 2020 |
| 2 |
Effect of the NBD-group position on interaction of fluorescently-labeled cholesterol analogues with human steroidogenic acute regulatory protein STARD1
Tugaeva KV, Faletrov YV, Allakhverdiev ES, Shkumatov VM, Maksimov EG, Sluchanko NN
Biochemical and Biophysical Research Communications, 497(1), 58, 2018 |
| 3 |
Semi-empirical quantum evaluation of peptide - MHC class II binding
Gonzalez R, Suarez CF, Bohorquez HJ, Patarroyo MA, Patarroyo ME
Chemical Physics Letters, 668, 29, 2017 |
| 4 |
Metal Coordination Stoichiometry Controlled Formation of Linear and Hyperbranched Supramolecular Polymers
Lin CL, Xu LN, Huang LB, Chen J, Liu YY, Ma YF, Ye FX, Qiu HY, He T, Yin SC
Macromolecular Rapid Communications, 37(17), 1453, 2016 |
| 5 |
Rationalization of Activity Cliffs of a Sulfonamide Inhibitor of DNA Methyltransferases with Induced-Fit Docking
Medina-Franco JL, Mendez-Lucio O, Yoo J
International Journal of Molecular Sciences, 15(2), 3253, 2014 |
| 6 |
Main-Chain Supramolecular Polymers Based on Orthogonal Benzo-21-Crown-7/Secondary Ammonium Salt and Terpyridine/Metal Ion Recognition Motifs
Tian YK, Wang F
Macromolecular Rapid Communications, 35(3), 337, 2014 |
| 7 |
Dependence of Interaction Free Energy between Solutes on an External Electrostatic Field
Yang PK
International Journal of Molecular Sciences, 14(7), 14408, 2013 |
| 8 |
Development of a fluorescently labeled thermostable DHFR for studying conformational changes associated with inhibitor binding
Goodey NM, Alapa MT, Hagmann DF, Korunow SG, Mauro AK, Kwon KS, Hall SM
Biochemical and Biophysical Research Communications, 413(3), 442, 2011 |
| 9 |
Binding site and interlobe interactions of the ionotropic glutamate receptor GluK3 ligand binding domain revealed by high resolution crystal structure in complex with (S)-glutamate
Venskutonyte R, Frydenvang K, Gajhede M, Bunch L, Pickering DS, Kastrup JS
Journal of Structural Biology, 176(3), 307, 2011 |
| 10 |
Advances and Challenges in Protein-Ligand Docking
Huang SY, Zou XQ
International Journal of Molecular Sciences, 11(8), 3016, 2010 |
