TY  - JOUR
AU  - Maggi, Luca
AU  - Carloni, P.
AU  - Rossetti, G.
TI  - Vibrational Energy in Proteins Correlates with Topology
JO  - The journal of physical chemistry letters
VL  - 9
IS  - 22
SN  - 1948-7185
CY  - Washington, DC
PB  - ACS
M1  - FZJ-2018-06520
SP  - 6393 - 6398
PY  - 2018
AB  - The exchange of vibrational energy in proteins is crucial for their function. Here, we establish a connection between quantities related to it with geometry-based properties such as the proteins’ residues coordination number. This relation is proven by molecular simulation in a neuro-pharmacologically relevant transmembrane receptor. The connection demonstrated here paves the way to studies of protein allostery and conformational changes based solely on protein structure
LB  - PUB:(DE-HGF)16
C6  - pmid:30358398
UR  - <Go to ISI:>//WOS:000451362100002
DO  - DOI:10.1021/acs.jpclett.8b02380
UR  - https://juser.fz-juelich.de/record/857529
ER  -