SMSD icon indicating copy to clipboard operation
SMSD copied to clipboard

Image generation problems for N-MCS

Open gilleain opened this issue 13 years ago • 1 comments

If large numbers of targets are used for N-MCS, the java process is highly likely to run out of memory when generating the image. This is because the standard 'subcanvas' size is 300x300, so with 100 molecules this is a circle with a circumference of 30,000 pixels.

Possibly a maximum limit (for number of molecules) could be worked out, or maximum dimensions for the output image. The user can now specify subCanvas dimensions on the command line with "-d WxH" for width x height, although the minimum size for readability is around 50x50.

gilleain avatar Apr 25 '11 18:04 gilleain

Good idea!

asad avatar Apr 25 '11 21:04 asad