The CHARMM-TURBOMOLE interface for efficient and accurate QM/MM molecular dynamics, free energies, and excited state properties

Saleh Riahi, Christopher N. Rowley. The CHARMM-TURBOMOLE interface for efficient and accurate QM/MM molecular dynamics, free energies, and excited state properties. Journal of Computational Chemistry, 35(28):2076-2086, 2014. [doi]

Abstract

Abstract is missing.