Alexandre Fassio

Hi there, Thanks for sharing. I've already noticed this issue and I'm working on updating LUNA to accept any Biopython version. I've not removed the version restriction in the ENV...

Hi @abazabaaa **1 -** Regarding your question about the LUNA being best set up to generate IFPs for a single rigid protein and a large number of ligands, that isn't...

Please, let me know if you need any further help. bests

Thanks, @pducrot, for letting me know about this bug and your interest in LUNA. However, based on your code, it seems you're repo is not the latest LUNA version. For...

Hi, @linminhtoo!!! Thanks for your interest in using LUNA and for your kind words. So let me try to answer your question on top of what @mjke already brought up....

Thanks @davidRFB and @Anupam-5 for letting me know about this issue. I've just made a commit to solve the problem. If you download LUNA again from git, @Anupam-5, you should...

Hi @userscy After debugging the code for a while I figured out two things about this issue. 1) You need to modify line # 17 from diffab/utils/transforms.merge.py as shown below:...