Ref/molstr/atom

Ref/molstr

name

; get atom name

 string name ()

elem

; get element name

 string elem ()

pos

; get position

 vector pos ()

bfac

; get B-factor

 real bfac ()

occ

; get occupancy

 real occ ()

id

; get atoms unique ID

 integer id()

setPos

; set position

 void setPos(vector)

setBfac

; set B-factor

 void setBfac(real)

setOcc

; set occupancy

 void setOcc(real)

resid

 integer resid()

resn

 string resn()

chain

 string chain()