On 08/20/2014 12:34 PM, Greg Landrum wrote: > On Wednesday, August 20, 2014, Michał Nowotka <[email protected]> wrote:
>> It seems that adding this flag actually calls Compute2dCoords (at >> least this is how it looks like), because all coordinates are computed >> from scratch, > Hmmm, that doesn't sound like what is supposed to happen. I think that > it should just add coords for the Hs that it adds. Unless your backbone is laid out so there's room around it for all those protons, expect the result to not look good. -- Dimitri Maziuk Programmer/sysadmin BioMagResBank, UW-Madison -- http://www.bmrb.wisc.edu
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