|
|
Difference between revisions of "gorex.pl"
From MMTSB
(klrYydzyHO) |
|||
| Line 1: | Line 1: | ||
| − | + | __NOTOC__ | |
| + | == Usage == | ||
| + | |||
| + | <mmtsbToolUsage cmd="convpdb.pl"></mmtsbToolUsage> | ||
| + | |||
| + | == Description == | ||
Revision as of 20:30, 23 December 2008
Usage
usage: convpdb.pl [options] [PDBfile]
options: [-center] [-translate dx dy dz] [-orient]
[-rotate m11 m12 m13 m21 m22 m23 m31 m32 m33]
[-rotatex phi] [-rotatey phi] [-rotatez phi]
[-biomt num] [-smtry num]
[-scale factor] [-diff PDBfile] [-difflsqfit] [-add PDBFile]
[-nmode file amplitude weight]
[-nmodesample file prefix from to delta] [-skipzero]
[-sel list] [-exclude list]
[-chain id] [-model num] [-firstmodel] [-nohetero]
[-selseq abbrev]
[-nsel Selection]
[-merge pdbfile]
[-renumber start] [-addres value]
[-renumwatersegs]
[-match pdbfile]
[-setchain id] [-setseg id] [-setall]
[-readseg] [-chainfromseg] [-splitseg] [-alternate]
[-charmm19] [-amber]
[-out charmm19 | charmm22 | amber | generic]
[-genres]
[-crd] [-crdext] [-crdinp]
[-segnames]
[-fixcoo]
[-ssbond res1:res2[=res1:res2]] [-nossbond]
[-solvate] [-cutoff value] [-solvcut value]
[-octahedron] [-cubic]
[-ions NAME:num[=NAME:num]]
[-replace PDB:num]
[-info] [-listseg] [-residues] [-rescount]
[-fill inx:seq]
[-mol2]
[-cleanaux]
[-setaux1 value] [-setaux2 value]
[-removeclashes] [-clashes] [-clashcut value]
[-wrap boxx boxy boxz] [-by chain|atom|system]
[-reimage cx cy cz]
