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Delin Sun
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Effect of arginine-rich cell penetrating peptides on membrane pore formation and life-times: A molecular simulation study
D Sun, J Forsman, M Lund, CE Woodward
Physical Chemistry Chemical Physics 16 (38), 20785-20795, 2014
642014
Multistep molecular dynamics simulations identify the highly cooperative activity of melittin in recognizing and stabilizing membrane pores
D Sun, J Forsman, CE Woodward
Langmuir 31 (34), 9388-9401, 2015
532015
Protonation state of inhibitors determines interaction sites within voltage-gated sodium channels
A Buyan, D Sun, B Corry
Proceedings of the National Academy of Sciences 115 (14), E3135-E3144, 2018
482018
Effect of water content on microstructures and oxygen permeation in PSiMA–IPN–PMPC hydrogel: a molecular simulation study
D Sun, J Zhou
Chemical engineering science 78, 236-245, 2012
482012
Predicting small molecule transfer free energies by combining molecular dynamics simulations and deep learning
WFD Bennett, S He, CL Bilodeau, D Jones, D Sun, H Kim, JE Allen, ...
Journal of Chemical Information and Modeling 60 (11), 5375-5381, 2020
442020
Computer simulations on the pH-sensitive tri-block copolymer containing zwitterionic sulfobetaine as a novel anti-cancer drug carrier
W Min, D Zhao, X Quan, D Sun, L Li, J Zhou
Colloids and Surfaces B: Biointerfaces 152, 260-268, 2017
432017
Computer simulations on a pH-responsive anticancer drug delivery system using zwitterion-grafted polyamidoamine dendrimer unimolecular micelles
S Zeng, X Quan, H Zhu, D Sun, Z Miao, L Zhang, J Zhou
Langmuir 37 (3), 1225-1234, 2021
362021
Evaluating force fields for the computational prediction of ionized arginine and lysine side-chains partitioning into lipid bilayers and octanol
D Sun, J Forsman, CE Woodward
Journal of Chemical Theory and Computation 11 (4), 1775-1791, 2015
342015
Atomistic molecular simulations suggest a kinetic model for membrane translocation by arginine-rich peptides
D Sun, J Forsman, CE Woodward
The Journal of Physical Chemistry B 119 (45), 14413-14420, 2015
332015
Ionic liquid confined in Nafion: toward molecular‐level understanding
D Sun, J Zhou
AIChE Journal 59 (7), 2630-2639, 2013
332013
Molecular simulations of melittin-induced membrane pores
D Sun, J Forsman, CE Woodward
The Journal of Physical Chemistry B 121 (44), 10209-10214, 2017
292017
Molecular mechanism of HIV-1 TAT peptide and its conjugated gold nanoparticles translocating across lipid membranes
X Quan, D Sun, J Zhou
Physical Chemistry Chemical Physics 21 (20), 10300-10310, 2019
272019
Phase behavior of an amphiphilic block copolymer in ionic liquid: A dissipative particle dynamics study
J Mai, D Sun, L Li, J Zhou
Journal of Chemical & Engineering Data 61 (12), 3998-4005, 2016
262016
Amphipathic membrane-active peptides recognize and stabilize ruptured membrane pores: Exploring cause and effect with coarse-grained simulations
D Sun, J Forsman, CE Woodward
Langmuir 31 (2), 752-761, 2015
242015
Computer simulations of the adsorption of an N-terminal peptide of statherin, SN15, and its mutants on hydroxyapatite surfaces
M Luo, Y Gao, S Yang, X Quan, D Sun, K Liang, J Li, J Zhou
Physical Chemistry Chemical Physics 21 (18), 9342-9351, 2019
222019
Molecular Simulation of Oxygen Sorption and Diffusion in the Poly (lactic acid)
SUN Delin, Z Jian
Chinese Journal of Chemical Engineering 21 (3), 301-309, 2013
222013
Impact of electronic polarizability on protein-functional group interactions
H Goel, W Yu, VD Ustach, AH Aytenfisu, D Sun, AD MacKerell
Physical Chemistry Chemical Physics 22 (13), 6848-6860, 2020
202020
Dissipative particle dynamics simulations on mesoscopic structures of Nafion and PVA/Nafion blend membranes
DL SUN, J Zhou
Acta Physico-Chimica Sinica 28 (4), 909-916, 2012
182012
Determination of ionic hydration free energies with grand canonical Monte Carlo/molecular dynamics simulations in explicit water
D Sun, SK Lakkaraju, S Jo, AD MacKerell Jr
Journal of chemical theory and computation 14 (10), 5290-5302, 2018
172018
Molecular simulations of charged complex fluids: A review
Z Xu, Z He, X Quan, D Sun, Z Miao, H Yu, S Yang, Z Chen, J Zeng, J Zhou
Chinese Journal of Chemical Engineering 31, 206-226, 2021
152021
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Articles 1–20