Interactive molecular dynamics (IMD)

Collaboration diagram for Interactive molecular dynamics (IMD):

Description

Allows mdrun to interface with VMD via the interactive molecular dynamics (IMD) protocol.

Author

Martin Hoefling, Carsten Kutzner ckutz.nosp@m.ne@g.nosp@m.wdg.d.nosp@m.e

Todo:

Rename the directory, source and test files to interactive_md, and prefer type names like InteractiveMDSession. Avoid ambiguity with IMDModule.

Files
file	imd.cpp
	Implements Interactive Molecular Dynamics.
file	imd.h
	This file declares the class that coordinates with VMD via the Interactive Molecular Dynamics protocol, along with supporting free functions.
file	imdsocket.cpp
	Implements functions of imdsocket.h.
file	imdsocket.h
	Implements the parts of the vmdsock.h interface needed for IMD communication.