Markus Meuwly

SCN as a local probe of protein structural dynamics.

Seyedeh Maryam Salehi, K. Töpfer, Sena Aydin, 2024, The Journal of chemical physics.

CHARMM at 45: Enhancements in Accessibility, Functionality, and Speed

Phillip S. Hudson, Justin A. Lemkul, Andrew C. Simmonett, 2024, The journal of physical chemistry. B.

Force Fields for Deep Eutectic Mixtures: Application to Structure, Thermodynamics and 2D-Infrared Spectroscopy.

A. Pasti, K. Töpfer, Eric D. Boittier, 2024, The journal of physical chemistry. B.

Kernel-Based Minimal Distributed Charges: A Conformationally Dependent ESP-Model for Molecular Simulations.

K. Töpfer, Eric D. Boittier, M. Devereux, 2024, Journal of chemical theory and computation.

High-Energy Reaction Dynamics of N3.

Juan Carlos San Vicente Veliz, Markus Meuwly, JingChun Wang, 2024, The journal of physical chemistry. A.

Force Fields for Deep Eutectic Mixtures: Application to Structure and 2D-Infrared Spectroscopy

A. Pasti, Eric D. Boittier, M. Devereux, 2022 .

Energy relaxation of N2O in gaseous, supercritical, and liquid xenon and SF6.

S. Erramilli, K. Töpfer, Lawrence D. Ziegler, 2024, The Journal of chemical physics.