The Center for Computation and Theory of Soft Material

Fingerprint Dive into the research topics where The Center for Computation and Theory of Soft Material is active. These topic labels come from the works of this organization's members. Together they form a unique fingerprint.

Molecular dynamics Chemical Compounds
Water Chemical Compounds
Polyelectrolytes Chemical Compounds
Ions Chemical Compounds
Multilayers Chemical Compounds
molecular dynamics Physics & Astronomy
Ionic Liquids Chemical Compounds
Computer simulation Chemical Compounds

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Profiles

No photo of Baofu Qiao
20042019

Research Output 2004 2019

Atomistic simulation of PDADMAC/PSS oligoelectrolyte multilayers: Overall comparison of tri- And tetra-layer systems

Sánchez, P. A., Vögele, M., Smiatek, J., Qiao, B., Sega, M. & Holm, C., Jan 1 2019, In : Soft Matter. 15, 46, p. 9437-9451 15 p.

Research output: Contribution to journalArticle

Ammonium Chloride
ammonium chlorides
sulfonates
polystyrene
Multilayers
4 Citations (Scopus)

Ion association with tetra-n-alkylammonium cations stabilizes higher-oxidation-state neptunium dioxocations

Estes, S. L., Qiao, B. & Jin, G. B., Dec 1 2019, In : Nature communications. 10, 1, 59.

Research output: Contribution to journalArticle

Open Access
Neptunium
neptunium
Cations
Association reactions
Ions
1 Citation (Scopus)

"Mirror"-like Protein Dimers Stabilized by Local Heterogeneity at Protein Surfaces

Qiao, B., Lopez, L. & Olvera de la Cruz, M., May 9 2019, In : Journal of Physical Chemistry B. 123, 18, p. 3907-3915 9 p.

Research output: Contribution to journalArticle

Dimers
Membrane Proteins
Mirrors
dimers
mirrors