1. Brunel University Research Archive

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Results 1-10 of 13 (Search time: 0.018 seconds).
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Issue DateTitleAuthor(s)
16-Jan-2017Nanowire Stretching by Non-Equilibrium Molecular DynamicsHeyes, DM; Dini, D; Smith, ER; Brańka, AC
31-May-2019Conformational coupling by trans-phosphorylation in calcium-calmodulin-dependent kinase IIPandini, A; Schulman, H; Khan, S
25-Feb-2022PathDetect-SOM: A Neural Network Approach for the Identification of Pathways in Ligand Binding SimulationsMotta, S; Callea, L; Bonati, L; Pandini, A
8-Jun-2022A systematic analysis of the memory term in coarse-grained models: The case of the Markovian approximationDi Pasquale, N; Hudson, T; Icardi, M; Rovigatti, L; Spinaci, M
8-Nov-2023Effect of temperature on interfacial properties of CO2/H2 mixtures contacting with brine and hydrophilic silica by molecular dynamics simulationsChen, C; Xia, J; Bahai, H
31-Oct-2018Conformational flexibility of histone variant CENP-A<sup>Cse4</sup> is regulated by histone H4: A mechanism to stabilize soluble Cse4Malik, N; Dantu, SC; Shukla, S; Kombrabail, M; Ghosh, SK; Krishnamoorthy, G; Kumar, A
29-Jan-2022A molecular simulation study on transport properties of FAMEs in high-pressure conditionsChen, C; Mira, D; Jiang, X
5-Aug-2022Towards predicting liquid fuel physicochemical properties using molecular dynamics guided machine learning modelsFreitas, RSM; Lima, ÁPF; Chen, C; Rochinha, FA; Mira, D; Jiang, X
1-Oct-2022Thermophysical property prediction of biodiesel mixtures at extreme conditions using molecular dynamics simulationChen, C; Mira, D; Xing, Z; Jiang, X
29-Apr-2022Understanding the miscibility of polyoxymethylene dimethyl ethers (OME<inf>n</inf>) and diesel blend using molecular dynamics simulationYu, M; Chen, C; Jiang, X

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