Allosteric effects of the oncogenic RasQ61L mutant on Raf-RBD SK Fetics, H Guterres, BM Kearney, G Buhrman, B Ma, R Nussinov, ... Structure 23 (3), 505-516, 2015 | 237 | 2015 |
Improving protein-ligand docking results with high-throughput molecular dynamics simulations H Guterres, W Im Journal of chemical information and modeling 60 (4), 2189-2198, 2020 | 224 | 2020 |
Raf promotes dimerization of the Ras G-domain with increased allosteric connections MR Packer, JA Parker, JK Chung, Z Li, YK Lee, T Cookis, H Guterres, ... Proceedings of the National Academy of Sciences 118 (10), e2015648118, 2021 | 53 | 2021 |
Ligand-binding-site refinement to generate reliable holo protein structure conformations from apo structures H Guterres, SJ Park, W Jiang, W Im Journal of chemical information and modeling 61 (1), 535-546, 2020 | 22 | 2020 |
Molecular basis of polyspecific drug and xenobiotic recognition by OCT1 and OCT2 Y Suo, NJ Wright, H Guterres, JG Fedor, KJ Butay, MJ Borgnia, W Im, ... Nature structural & molecular biology 30 (7), 1001-1011, 2023 | 17 | 2023 |
CHARMM‐GUI high‐throughput simulator for efficient evaluation of protein–ligand interactions with different force fields H Guterres, SJ Park, H Zhang, T Perone, J Kim, W Im Protein Science 31 (9), e4413, 2022 | 17 | 2022 |
Ligand-binding-site structure refinement using molecular dynamics with restraints derived from predicted binding site templates H Guterres, HS Lee, W Im Journal of chemical theory and computation 15 (11), 6524-6535, 2019 | 17 | 2019 |
CHARMM-GUI Ligand Designer for Template-Based Virtual Ligand Design in a Binding Site H Guterres, SJ Park, Y Cao, W Im Journal of chemical information and modeling 61 (11), 5336-5342, 2021 | 9 | 2021 |
CHARMM-GUI LBS Finder & Refiner for Ligand Binding Site Prediction and Refinement H Guterres, SJ Park, H Zhang, W Im Journal of chemical information and modeling 61 (8), 3744-3751, 2021 | 9 | 2021 |
Molecular basis of polyspecific drug binding and transport by OCT1 and OCT2 Y Suo, NJ Wright, H Guterres, JG Fedor, KJ Butay, MJ Borgnia, W Im, ... bioRxiv, 2023 | 8 | 2023 |
CHARMM-GUI-Based Induced Fit Docking Workflow to Generate Reliable Protein–Ligand Binding Modes H Guterres, W Im Journal of Chemical Information and Modeling 63 (15), 4772-4779, 2023 | 5 | 2023 |
Mechanisms of isoform-specific residue influence on GTP-bound HRas, KRas, and NRas AY Volmar, H Guterres, H Zhou, D Reid, S Pavlopoulos, L Makowski, ... Biophysical Journal 121 (19), 3616-3629, 2022 | 5 | 2022 |
Predicting X‐ray solution scattering from flexible macromolecules H Zhou, H Guterres, C Mattos, L Makowski Protein Science 27 (12), 2023-2036, 2018 | 3 | 2018 |
Ras Residue Y71 Promotes Flexibility of Switch I and Switch II H Guterres, C Mattos The FASEB Journal 31, 913.15-913.15, 2017 | 2 | 2017 |
Induced fit docking workflow based on charmm-gui modules: LBS Finder & Refiner and High-Throughput Simulator H Guterres, W Im Biophysical Journal 121 (3), 50a, 2022 | 1 | 2022 |
CHARMM-GUI high-throughput simulator SJ Park, H Guterres, H Zhang, W Im Biophysical Journal 121 (3), 531a, 2022 | | 2022 |
Raf promotes Ras dimerization M Packer, J Parker, J Chung, Z Li, Y Lee, T Cookis, H Guterres, S Alvarez, ... PROTEIN SCIENCE 30, 132-132, 2021 | | 2021 |
Raf promotes dimerization of the Ras G‐domain MR Packer, JA Parker, JK Chung, Z Li, YK Lee, H Guterres, T Cookis, ... The FASEB Journal 34 (S1), 1-1, 2020 | | 2020 |
Ras Structure, Dynamics and Conformational States Assessed by MD Simulations and Solution Wide angle X‐ray Scattering AY Volmar, H Guterres, H Zhou, C Mattos, L Makowski The FASEB Journal 34 (S1), 1-1, 2020 | | 2020 |
Combined Computational and Solution Scattering Methods to Study the Dynamical Properties of Ras H Guterres Northeastern University, 2018 | | 2018 |