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Computational and Structural Biotechnology Journal (CSBJ)
csbj.org
did:plc:wrjhotm4fkgxdiegjanun7zq
🧪 How can customized molecular simulations reshape the search for new therapeutics?
🔗 Predicting fragment binding modes using customized Lennard-Jones potentials in short molecular dynamics simulations. DOI: https://doi.org/10.1016/j.csbj.2024.12.017
📚 CSBJ: www.csbj.org
#DrugDiscovery #ComputationalChemistry
2025-05-06T16:19:58.983Z