Sophia K. Johnson - Publications, H-index & Citations

Sophia K. Johnson

swiss federal institutes of technology domain

3H指数

11论文数

34被引数

收录论文 6

发表时间

Modeling chemical reactivity in complex systems: Insights from hybrid QM/MM MD simulations 复杂体系中化学活性的建模：来自混合QM/MM MD模拟的见解

Journal of Catalysis

IF6.5

2025-11-05

PREAI

Andrea Levy; Vladislav Slama; Salomé Guilbert; Andrej Antalík; Sophia K. Johnson; Guido Frisari; Ursula Rothlisberger

Making Puzzle Pieces Fit or Reshaping MiMiC for Multiscale Simulations with CP2K and More 将拼图碎片拼合或重塑MiMiC以进行多尺度模拟，使用CP2K和更多工具

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2025-05-06

PREAI

Antalik, Andrej; Levy, Andrea; Johnson, Sophia K.; Olsen, Jogvan MagnusHaugaard; Rothlisberger, Ursula

MiMiC: A high-performance framework for multiscale molecular dynamics simulations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-07-11

OAAI

Antalik, Andrej; Levy, Andrea; Kvedaraviciute, Sonata; Johnson, Sophia K.; Carrasco-Busturia, David; Raghavan, Bharath; Mouvet, Francois; Acocella, Angela; Das, Sambit; Gavini, Vikram; Mandelli, Davide; Ippoliti, Emiliano; Meloni, Simone; Carloni, Paolo; Rothlisberger, Ursula; Olsen, Jogvan Magnus Haugaard

Redox-Based Defect Detection in Packed DNA: Insights from Hybrid Quantum Mechanical/Molecular Mechanics Molecular Dynamics Simulations

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2023-11-14

OAAI

Kilic, Murat; Diamantis, Polydefkis; Johnson, Sophia K.; Toth, Oliver; Rothlisberger, Ursula

MiMiCPy: An Efficient Toolkit for MiMiC-Based QM/MM Simulations

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2023-02-22

OAAI

Raghavan, Bharath; Schackert, Florian K.; Levy, Andrea; Johnson, Sophia K.; Ippoliti, Emiliano; Mandelli, Davide; Olsen, Jogvan Magnus Haugaard; Rothlisberger, Ursula; Carloni, Paolo

Computational investigation of functionalized carbenes on dinitrogen activation

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2022-12-08

OAAI

Kirkland, Justin K.; Johnson, Sophia K.; Vogiatzis, Konstantinos D.

研究方向