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Nano-scale modeling / Molecular modeling

B
bddalton
Tue, Apr 25, 2017 1:19 AM

Can this software be used to modeling on the molecular scale?  I need to make
a water filter model for my research.
Best,
Brian

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Can this software be used to modeling on the molecular scale? I need to make a water filter model for my research. Best, Brian -- View this message in context: http://forum.openscad.org/Nano-scale-modeling-Molecular-modeling-tp21371.html Sent from the OpenSCAD mailing list archive at Nabble.com.
M
MichaelAtOz
Tue, Apr 25, 2017 3:09 AM

Hi,

Yes & No.

OpenSCAD is unitless, so theoretically if you can work in  64 bit IEEE
floating point OpenSCAD limits
https://en.wikibooks.org/wiki/OpenSCAD_User_Manual/General#Values_and_Data_Types
, you should be good.

However, ATM there are issues with small numbers. If you operate at, say, a
scale 10000 times bigger, then scale down the final result by 10000 then it
should be OK. But you'd want to do some early testing to make sure.
(Depending how small you want to go 100,000 maybe wise)


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View this message in context: http://forum.openscad.org/Nano-scale-modeling-Molecular-modeling-tp21371p21372.html
Sent from the OpenSCAD mailing list archive at Nabble.com.

Hi, Yes & No. OpenSCAD is unitless, so theoretically if you can work in 64 bit IEEE floating point OpenSCAD limits <https://en.wikibooks.org/wiki/OpenSCAD_User_Manual/General#Values_and_Data_Types> , you should be good. However, ATM there are issues with small numbers. If you operate at, say, a scale 10000 times bigger, then scale down the final result by 10000 then it should be OK. But you'd want to do some early testing to make sure. (Depending how small you want to go 100,000 maybe wise) ----- Admin - PM me if you need anything, or if I've done something stupid... Unless specifically shown otherwise above, my contribution is in the Public Domain; to the extent possible under law, I have waived all copyright and related or neighbouring rights to this work. Obviously inclusion of works of previous authors is not included in the above. The TPP is no simple “trade agreement.” Fight it! http://www.ourfairdeal.org/ time is running out! -- View this message in context: http://forum.openscad.org/Nano-scale-modeling-Molecular-modeling-tp21371p21372.html Sent from the OpenSCAD mailing list archive at Nabble.com.