Topology Manipulation
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Navigation: Documentation / Commands / Topology Manipulation
Command | Description |
top2delphi | extract radii and charges for calculation in delphi |
top2params | extract force field parameters from topology |
topcharges | manipulate with atomic charges in topology |
topcut | create a subtopology from topology |
topinfo | print info about topology |
topjoinmol | change number of atoms in solute (for pressure scaling) |
topmask | print atoms according to a mask |
topremixlj | remix LJ parameters for unlike atoms |