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List of works by Libo Li

Assessing atomistic and coarse-grained force fields for protein-lipid interactions: the formidable challenge of an ionizable side chain in a membrane.

scientific article

Computer simulations on the pH-sensitive tri-block copolymer containing zwitterionic sulfobetaine as a novel anti-cancer drug carrier

scientific article published on 19 January 2017

Field-SEA: a model for computing the solvation free energies of nonpolar, polar, and charged solutes in water

scientific article published on 13 December 2013

Lysozyme Adsorption on Porous Organic Cages: A Molecular Simulation Study

scientific article published on 08 October 2020

Novel inorganic-organic-layered structures: crystallographic understanding of both phase and morphology formations of one-dimensional CdE (E = S, Se, Te) nanorods in ethylenediamine

scientific article published in April 2003

Paralyzed membrane: Current-driven synthesis of a metal-organic framework with sharpened propene/propane separation

scientific article published on 05 November 2018

Potential of mean force and pKa profile calculation for a lipid membrane-exposed arginine side chain

scientific article published on 18 July 2008

Small molecule solvation changes due to the presence of salt are governed by the cost of solvent cavity formation and dispersion.

scientific article published on December 2014

Testing the semi-explicit assembly model of aqueous solvation in the SAMPL4 challenge

scientific article published on 29 January 2014

The different interactions of lysine and arginine side chains with lipid membranes

scientific article published on 27 September 2013

The role of membrane thickness in charged protein-lipid interactions.

scientific article

Understanding the Cellular Uptake of pH-Responsive Zwitterionic Gold Nanoparticles: A Computer Simulation Study

scientific article published on 22 November 2017

Water Transport with Ultralow Friction through Partially Exfoliated g-C3 N4 Nanosheet Membranes with Self-Supporting Spacers

scientific article published on 7 June 2017

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