Special Issue “Role of Molecular Dynamics Simulations and Related Methods in Drug Discovery”
Molecular dynamics (MD) simulations and related computational methodologies-such as binding free energy calculations and Markov state models-have become indispensable tools in modern drug discovery [...].
Authors
- Huanxiang Liu
Institutions
- Macao Polytechnic University (MO)
Publication Details
- Journal
- International Journal of Molecular Sciences
- Published
- 2025-12-26
- DOI
- https://doi.org/10.3390/ijms27010264
- Primary Topic
- Computational Drug Discovery Methods
- Type
- article
- Field-Weighted Citation Impact
- 0.00