Shuai Liu

16PUBLICATIONS
48CO-AUTHORS
Biomolecular modelling and designFluid-structure interaction and aeroacousticsMedical mycologyFormal methods for softwareMedical molecular engineering of nucleic acids and proteins
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Publications (16)

|Nov 02, 2026
Experimental and Computational Characterization of Human Serum Albumin Recognition by Ga(III)-NOTA Dendrimer Nanomicelles with Distinct PET Biodistribution Profiles.

|May 04, 2026
Benchmarking OPLS-AA and OpenFF for HDI-PEG Thermoplastic Polyurethanes with Varying Soft-Segment Length.

|Apr 29, 2026
Gaining insights into MmpL3: combining structural and computational approaches to unlock transport and inhibitor-binding mechanisms.

|Aug 18, 2025
alchemlyb: the simple alchemistry library.

Zhiyi Wu, David L Dotson, Irfan Alibay

|Sep 25, 2024
Targeting the phosphatidylglycerol lipid: An amphiphilic dendrimer as a promising antibacterial candidate.

Nian Zhang, Dinesh Dhumal, Shanny Hsuan Kuo

|Apr 27, 2024
Molecular Ballet: Investigating the Complex Interaction between Self-Assembling Dendrimers and Human Serum Albumin via Computational and Experimental Methods.

Gabriele Cavalieri, Domenico Marson, Nicoletta Giurgevich

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Frequent Collaborators

8 joint publications

Sabrina Pricl

4 joint publications

Ling Peng

3 joint publications

Erik Laurini

2 joint publications

Paola Posocco