Roberto A. Rodriguez

Computing Protein-Protein Association Affinity with Hybrid Steered Molecular Dynamics.

Liao Y. Chen, Lili Yu, Roberto A. Rodriguez, 2015, Journal of chemical theory and computation.

Computing the binding affinity of a ligand buried deep inside a protein with the hybrid steered molecular dynamics.

Liao Y. Chen, Oscar D Villarreal, Lili Yu, 2017, Biochemical and biophysical research communications.

Quantitative study of unsaturated transport of glycerol through aquaglyceroporin that has high affinity for glycerol

Liao Y. Chen, Huiyun Liang, Roberto A. Rodriguez, 2020, bioRxiv.

Single-channel permeability and glycerol affinity of human aquaglyceroporin AQP3.

Liao Y. Chen, Huiyun Liang, Roberto A. Rodriguez, 2019, Biochimica et biophysica acta. Biomembranes.

Computing Osmotic Permeabilities of Aquaporins AQP4, AQP5, and GlpF from Near-Equilibrium Simulations

Liao Y. Chen, Roberto A. Rodriguez, Thierry O. Wambo, 2017, bioRxiv.

1,3‐propanediol binds deep inside the channel to inhibit water permeation through aquaporins

Liao Y. Chen, C. Yeh, Lili Yu, 2015, Protein science : a publication of the Protein Society.

Molecular dynamics simulations on the effect of size and shape on the interactions between negative Au18(SR)14, Au102(SR)44 and Au144(SR)60 nanoparticles in physiological saline.

Lili Yu, Roberto A. Rodriguez, Thierry O. Wambo, 2016, Colloids and surfaces. A, Physicochemical and engineering aspects.

Development of a charged model of the SARS-CoV-2 viral surface

James E. Parker, Roberto A. Rodriguez, 2023, Biochimica et Biophysica Acta (BBA) - Biomembranes.

Thermodynamics of Amyloid-β Fibril Elongation: Atomistic Details of the Transition State

Liao Y. Chen, Roberto A. Rodriguez, G. Plascencia‐Villa, 2017, ACS chemical neuroscience.