FLIP
FLIP a b c d e
FLIP must be followed by five integers, defining
how a chiral centre is to be changed. The first integer
is the atom number of the centre to be inverted, the
second and third are two atoms which do not move, and
the fourth and fifth are two atoms which do move.
FLIP works out which sidechains need to be moved,
checks for rings that would make this impossible and then
does the inversion.
Note:
FLIP a b c d e
and
FLIP a d e b c
will do almost exactly the same thing, but there may be
very small differences.
Acca and Acca documentation:
© 1996,1997 J M Goodman, Cambridge.
Acca documentation may not be copied
without the written permission of the author.
|
