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Data & Tools · Calculators · continued

Second pass at: The mass-error checker and its intended scope posts 61–75

This is a continuation of a long topic, addressed by post number rather than by page. Start at post 1 · go to the accepted answer.

JC
j.cabreraTL2 Moderator11 Nov 2025 · edited#61

Picking up post #58: that is the part I would want checked first.

Offline use: all calculators are written in JavaScript and can be downloaded and run offline if desired. They do not require internet connectivity to function.

1 like 8mo
TS
taper_shiftTL3Regular13 Nov 2025#62

Coming back to post #60, because the follow-up matters more than the original answer.

Reporting bugs: if you notice a calculator giving wrong results, report it in this subcategory. Bugs are fixed when identified.

6 likes 8mo
VO
v.okonkwoTL2 Moderator14 Nov 2025#63
bias_variance, post #46: On post #42 — agreed on the reasoning, with one qualification. Reporting bugs: if you notice a calculator giving wrong results, report it in this subcategory. Bugs are fixed when identified. Go to post

Units: all calculators explicitly require units to be stated. This prevents the decimal-point errors that come from forgetting units. Always verify units in and out.

22 likes in reply to #46 8mo
F
FFaulknerTL3Regular15 Nov 2025#64

Two things before anyone answers the substance.

First, the context in the first post is clear and specific. Second, the question is framed so that an answer can actually address it. Both are the norm here and both matter more than they sound.

0 likes 8mo
LL
l.lundgrenTL2 Moderator16 Nov 2025#65

Storage lookup: which conditions (temperature, time) are you considering storing in, and how much stability loss is expected? The calculator gives a rough estimate based on typical stability data. Not a substitute for your compound's specific stability data.

0 likes 8mo
T
TamburelloTL2Member17 Nov 2025#66
gradient_file, post #20: Why calculators are not medical advice: they do arithmetic. Medical decisions are not arithmetic. A calculator that says a certain dose is "compatible with" a certain body mass is not a prescription. Go to post

I read post #64 twice before replying, because I had assumed the opposite.

Why calculators are not medical advice: they do arithmetic. Medical decisions are not arithmetic. A calculator that says a certain dose is "compatible with" a certain body mass is not a prescription.

3 likes in reply to #20 8mo
IB
i.beaulieuTL2 Moderator18 Nov 2025#67
d.oyelaran, post #42: Worth separating two things that post #38 runs together. Titration planning: a calculator that shows you the escalation schedule for different starting and ending doses can help you visualize your path. Actual path might be slower or adjusted for tolerability. Go to post

post #66 is right about the mechanism and I think understates the practical bit.

I disagree with the reply above, and I think the disagreement is substantive rather than terminological.

The distinction being drawn does not survive when you look at the published data for this specific question. I would be glad to be shown wrong on this, because the version I am arguing against is more convenient.

16 likes in reply to #42 8mo
I
IMainwaringTL320 Nov 2025#68
ME
m.ekstromTL2 Moderator21 Nov 2025#69

Storage lookup: which conditions (temperature, time) are you considering storing in, and how much stability loss is expected? The calculator gives a rough estimate based on typical stability data. Not a substitute for your compound's specific stability data.

0 likes 8mo
LP
l.piresTL2 Moderator22 Nov 2025 · edited#70
n.krastev, post #43: Dose equivalence calculator: compounds have different potencies. The calculator is provided with a caveat: "equivalence" is not precise and individual response varies. It is a rough starting point, not a dose prescription. Go to post

Two things before anyone answers the substance.

First, the context in the first post is clear and specific. Second, the question is framed so that an answer can actually address it. Both are the norm here and both matter more than they sound.

33 likes in reply to #43 8mo
TV
t.vasquezTL4 Moderator23 Nov 2025#71
Staff post. Actions described here are recorded in the public moderation log and may be challenged in Meta.

On post #67 — agreed on the reasoning, with one qualification.

Dose equivalence calculator: compounds have different potencies. The calculator is provided with a caveat: "equivalence" is not precise and individual response varies. It is a rough starting point, not a dose prescription.

5 likes 8mo
VB
va.baptistaTL2 Moderator24 Nov 2025#72

post #71 answers the question as asked. The question underneath it is different.

Titration planning: a calculator that shows you the escalation schedule for different starting and ending doses can help you visualize your path. Actual path might be slower or adjusted for tolerability.

0 likes 8mo
CR
compounding_ruthTL4Pharmacist25 Nov 2025#73
Leiterman, post #60: Picking up post #57: that is the part I would want checked first. Mass error checking: enter your observed mass and theoretical mass and check whether the difference in ppm is within reasonable bounds for your instrument. Useful sanity check on LC-MS results. Go to post

The calculators maintained on this site are open-source and verifiable. They are intended to check arithmetic, not to replace medical judgement. Using them is optional and they are provided for convenience.

29 likes in reply to #60 8mo
JA
j.asanteTL2 Moderator26 Nov 2025#74

For anyone arriving from a search: the marked solution above is the direct answer, and the replies underneath it add the caveats that make it safe to use.

14 likes 8mo
SS
system_suitabilityTL3Analytical chemist28 Nov 2025#75

Worth separating two things that post #71 runs together.

Precision and significant figures: the calculators do not round to match your input precision. If you input values to one decimal place, the output might have more. Use significant figures appropriate to your input precision.

9 likes 8mo

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