João Rodrigues
João Rodrigues
This look good to me! Completely forgot about the testing instructions, thanks for catching this @npars !
>Would the sudo install version now be redundant? Yes. Also: for the installation from source, I'd actually leave the `-e` option out and simply do `pip install .`.
Hi @peterjc, sure. On it.
Yes, pretty much quite some interest! It's been on my mind for a long time but I honestly couldn't wrap my head around a good way of implementing this feature....
Hi @ozyo, the implementation I had looked at and liked the most was mdtraj's. Very nice, but a little complex, unfortunately GPL'ed so we can't just copy and adapt it...
Thank you for bringing this up, we should add a warning if this is the case. Does any of you want to take a shot at this patch?
Do you have a branch I can checkout locally and play with?
Ah, my bad, I might have induced you in error with my snippet. Once you `os.chdir` the original file path (`fname`) doesn't point to anywhere valid (unless it's an absolute...
Hi @sachdved, Thanks for the contribution! I have a few comments regarding the code and the nomenclature you used. The documentation for REMARK 350 is found [here](https://www.wwpdb.org/documentation/file-format-content/format33/remarks2.html#REMARK%20350). These are not...
This makes the code in `PDBIO` a little more convoluted than it needs to be, in my opinion. Could you change the chains of the residues themselves instead before writing?...