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{version = 2.20; (* of pemowe.p 1993 Jan 19}
(* begin module describe.pemowe *)
(*
name
pemowe: peptide molecular weights
synopsis
pemowe(book: in, list: out, output: out)
files
book: any book from the delila system. only one weight is given per
piece in the book. the first triplet of the piece is the first
codon translated.
list: a list of the piece numbers and names in the book, along with
the molecular weight of the peptide and
the number of atoms of the peptide for each piece.
output: messages to the user.
description
pemowe is designed to find the molecular weights of polypeptides
that might be coded by a particular sequence. it is to be used in
cases where one knows where a particular peptide is, not when one wants
the weights of all possible peptides. one should use delila to
construct the book. the calculation of the weights takes into account
loss of water for each peptide bond formed. calculation ends at stop
codons or at the end of the piece.
examples
sanger et. al., nature 265: 687 (1977) on page 692 gives a list of
calculated molecular weights from phix174. these can be used to test
pemowe, by using the delila instructions expepin. the largest deviation
from sanger's numbers is for gene j at 3 percent.
documentation
data is from the crc handbook of chemistry and physics 60th ed, 1980.
author
thomas d. schneider
bugs
only one peptide per piece is calculated. one could write another
program that predicted peptides (like lister), and generated
instructions for pulling out those peptides using delila.
*)
(* end module describe.pemowe *)
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