Search

Categories

Catalysis

(1)

Theoretical and Computational Chemistry

(2)

Content Types

Working Paper

(2)

Published Date

Last 3 years

(2)

Last 12 months

(1)

Last 6 months

(1)

Last 3 months

(1)

Keywords

Classical MD simulations

Authors

2 results in Keywords: Classical MD simulations

Understanding Substrate Binding and Reactivity of Stearoyl-CoA Desaturase (SCD1) through Classical and Multiscale Molecular Dynamics Simulations

Janko Čivić, Iñaki Tuñón, Jeremy Harvey

Version 1 posted 12 November 2024

107

Downloads

Theoretical and Computational Chemistry

Investigation of the Stability of D5SIC-DNAM-Incorporated DNA duplex in Taq Polymerase Binary system: A Systematic Classical MD Approach

Tanay Debnath, G. Andrés Cisneros

Version 2 posted 26 October 2023

213

Downloads