Collective variable approaches for single molecule flexible fitting and enhanced sampling.
Department of Chemical Engineering, University of New Hampshire , Durham, New Hampshire 03824, United States.
Harish
H
Vashisth
Georgios
G
Skiniotis
Charles Lee
CL
Brooks
D007328:Insulin / Q000737:chemistry / Q000378:metabolism; D008024:Ligands; D008958:Models, Molecular; D017434:Protein Structure, Tertiary; D011506:Proteins / Q000737:chemistry* / Q000378:metabolism; D013696:Temperature; D013816:Thermodynamics
D007328:Insulin; D008024:Ligands; D011506:Proteins