Coarse-grained (CG) molecular dynamics (MD) has become a method of choice for
simulating various large scale biomolecular processes; therefore, the systematic definition of …

Coarse-grained (CG) models of biomolecules have recently attracted considerable interest
because they enable the simulation of complex biological systems on length-scales and …

The development of coarse‐grained (CG) models for large biomolecules remains a
challenge in multiscale simulations, including a rigorous definition of CG representations for …

The study of very large biomolecular systems over extended spatial and temporal scales is
being accomplished through the use of coarse-grained (CG) models. The successes of …

Coarse-grained (CG) molecular dynamics (MD) can simulate systems inaccessible to fine-
grained (FG) MD simulations. A CG simulation decreases the degrees of freedom by …

A novel methodology is introduced here to generate coarse-grained (CG) representations of
molecular models for simulations. The proposed strategy relies on basic graph-theoretic …

Coarse-grained (CG) simulations have allowed access to larger length scales and longer
time scales in the study of the dynamic processes of large biomolecules than all-atom (AA) …

Coarse-grained (CG) models have allowed for the study of long time and length scale
properties of a variety of systems. However, when a system undergoes chemical reactions …

Construction of coarse-grained (CG) models for large biomolecules used for multiscale
simulations demands a rigorous definition of CG sites for them. Several coarse-graining …

Coarse-grained (CG) models are valuable tools for the study of functions of large
biomolecules on large length and time scales. The definition of CG representations for huge …