Showing results 8 to 19 of 19
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| Issue Date | Title | Author(s) |
| 13-Sep-2023 | The impact of binding energies on the necessary conditions in aerosol deposition | Daneshian, B; Gärtner, F; Weber, WE; Assadi, H; Klassen, T |
| 7-Apr-2018 | Mechanistic insights into the stimulant properties of novel psychoactive substances (Nps) and their discrimination by the dopamine transporter—in silico and in vitro exploration of dissociative diarylethylamines | Sahai, MA; Davidson, C; Dutta, N; Opacka-Juffry, J |
| 29-Jan-2022 | A molecular simulation study on transport properties of FAMEs in high-pressure conditions | Chen, C; Mira, D; Jiang, X |
| 16-Jan-2017 | Nanowire Stretching by Non-Equilibrium Molecular Dynamics | Heyes, DM; Dini, D; Smith, ER; Brańka, AC |
| 25-Feb-2022 | PathDetect-SOM: A Neural Network Approach for the Identification of Pathways in Ligand Binding Simulations | Motta, S; Callea, L; Bonati, L; Pandini, A |
| 28-Jan-2023 | A perspective on the microscopic pressure (stress) tensor: History, current understanding, and future challenges | Shi, K; Smith, ER; Santiso, EE; Gubbins, KE |
| 5-Feb-2021 | Size Effects of Brittle Particles in Aerosol Deposition—Molecular Dynamics Simulation | Daneshian, B; Gaertner, F; Assadi, H; Hoeche, D; Weber, W; Klassen, T |
| 8-Aug-2015 | Spontaneous Inward Opening of the Dopamine Transporter Is Triggered by PIP<inf>2</inf>-Regulated Dynamics of the N-Terminus | Khelashvili, G; Stanley, N; Sahai, MA; Medina, J; LeVine, MV; Shi, L; De Fabritiis, G; Weinstein, H |
| 8-Jun-2022 | A systematic analysis of the memory term in coarse-grained models: The case of the Markovian approximation | Di Pasquale, N; Hudson, T; Icardi, M; Rovigatti, L; Spinaci, M |
| 1-Oct-2022 | Thermophysical property prediction of biodiesel mixtures at extreme conditions using molecular dynamics simulation | Chen, C; Mira, D; Xing, Z; Jiang, X |
| 5-Aug-2022 | Towards predicting liquid fuel physicochemical properties using molecular dynamics guided machine learning models | Freitas, RSM; Lima, ÁPF; Chen, C; Rochinha, FA; Mira, D; Jiang, X |
| 29-Apr-2022 | Understanding the miscibility of polyoxymethylene dimethyl ethers (OME<inf>n</inf>) and diesel blend using molecular dynamics simulation | Yu, M; Chen, C; Jiang, X |
