| Dmff: an open-source automatic differentiable platform for molecular force field development and molecular dynamics simulation X Wang, J Li, L Yang, F Chen, Y Wang, J Chang, J Chen, W Feng, ... Journal of Chemical Theory and Computation 19 (17), 5897-5909, 2023 | 22 | 2023 |
| Small-angle X-ray scattering signatures of conformational heterogeneity and homogeneity of disordered protein ensembles J Song, J Li, HS Chan The Journal of Physical Chemistry B 125 (24), 6451-6478, 2021 | 21 | 2021 |
| A transferrable range-separated force field for water: Combining the power of both physically-motivated models and machine learning techniques L Yang, J Li, F Chen, K Yu The Journal of Chemical Physics 157 (21), 2022 | 9 | 2022 |
| Extending and Modifying LAMMPS Writing Your Own Source Code: A pragmatic guide to extending LAMMPS as per custom simulation requirements S Mubin, J Li, S Plimpton Packt Publishing Ltd, 2021 | 8 | 2021 |
| Molecular dynamics simulations of uniaxial deformation of bimodal polyethylene melts J Song, J Li, Z Li Polymer 213, 123210, 2021 | 7 | 2021 |
| Effects of temperature on microstructures of MSA-type electroplating solution: a coarse-grained molecular dynamics simulation T Li, C Liang, K Yu, J Li, C Lin, H Li, Y Xu, S Cai, Q Zhu, Q Huang, W Xing, ... Physical Chemistry Chemical Physics 25 (41), 28272-28281, 2023 | 2 | 2023 |
| Improving the hole mobility of conjugated semiconducting polymer films by fast backbone aggregation during the film formation process T Jin, J Li, H Li, X Liu, J Li, Q Zhang, X Yu, X Duan, Y Han Journal of Materials Chemistry C 12 (14), 5047-5061, 2024 | 1 | 2024 |
