Template:MassBank/IonFrequencyNeg - Revision history

Adm at 05:47, 26 July 2010

2010-07-26T05:47:57Z

Adm at 04:50, 26 July 2010

2010-07-26T04:50:47Z

Adm: New page: ==Negative Modes== {| class ="wikitable sortable" ! formula || mass || frequency || pages {{#Lua: FORMULA_PAT = "(C?[1-9]?[0-9]?)(H?[1-9]?[0-9]?)(C?l?[2-9]?)(F?[2-9]?)(I?[2-9]?)(N?[1-9]?...

2010-07-26T03:11:05Z

New page: ==Negative Modes== {| class ="wikitable sortable" ! formula || mass || frequency || pages {{#Lua: FORMULA_PAT = "(C?[1-9]?[0-9]?)(H?[1-9]?[0-9]?)(C?l?[2-9]?)(F?[2-9]?)(I?[2-9]?)(N?[1-9]?...

New page

==Negative Modes==
{| class ="wikitable sortable"
! formula || mass || frequency || pages
{{#Lua:
FORMULA_PAT = "(C?[1-9]?[0-9]?)(H?[1-9]?[0-9]?)(C?l?[2-9]?)(F?[2-9]?)(I?[2-9]?)(N?[1-9]?[0-9]?)(O?[1-9]?[0-9]?)(P?[2-9]?)(S?[2-9]?)";
FORMULA_CHAR = "CHFINOPSl0-9";
ATOM = {"C", "H", "Cl", "F", "I", "N", "O", "P", "S"};
MASS = {12, 1, 35, 19, 127, 14, 16, 31, 32};

function toFormula(t)
for i,v in pairs(t) do
if (v == "")
then t[i] = 0
else if (v == ATOM[i])
then t[i] = 1
else t[i]=tonumber(string.sub(v,1+string.len(ATOM[i])))
end
end
end
return t
end

function mass(str)
local t = toFormula({string.match(str,FORMULA_PAT)})
ret = 0;
for i,v in pairs(t) do
ret = ret + t[i] * MASS[i]
end
return ret;
end

F = {};
for id, fgmts in stdin:gmatch("&&([%a%d]+)(&&[%S]+)") do
for fgmt in string.gmatch(fgmts, "&&([%a%d]+)") do
if (not F[fgmt]) then F[fgmt] = {id} else table.insert(F[fgmt],id) end
end
end
count = 0
for i,v in pairs(F) do
count = count + 1;
print("{{#bar:}}-\n{{#bar:}}"..i.." {{#bar:}}{{#bar:}} "..mass(i).." {{#bar:}}{{#bar:}} "..table.getn(v).." {{#bar:}}{{#bar:}} [[Ojima:"..table.concat(v,"]], [[Ojima:") .."]]");
end
|
{{#SearchLine:^&&_%&&|Ojima|KOX_%n}}
}}
|}

@@ Line 3: / Line 3: @@
 ! formula || mass || frequency || pages
 {{#Lua:
-   FORMULA_PAT = "(C?[1-9]?[0-9]?)(H?[1-9]?[0-9]?)(Cl?[2-9]?)(F?[2-9]?)(I?[2-9]?)(N?[1-9]?[0-9]?)(O?[1-9]?[0-9]?)(P?[2-9]?)(S?[2-9]?)";
+   FORMULA_PAT = "(C?l?[1-9]?[0-9]?)(H?[1-9]?[0-9]?)(C?l?[2-9]?)(F?[2-9]?)(I?[2-9]?)(N?[1-9]?[0-9]?)(O?[1-9]?[0-9]?)(P?[2-9]?)(S?[2-9]?)";
    FORMULA_CHAR = "CHFINOPSl0-9";
    ATOM = {"C", "H", "Cl", "F", "I", "N", "O", "P", "S"};