Dear docking.org fans
Our OpenEye license has expired, and so a lot of things are currently broken. We are working with OpenEye to get this sorted out quickly, and hope to be back to normal working conditions very soon.
Is there any way to download the 2D images of compounds? I only see options to download .smi, .mol2, .sdf,...
I want to automatically download the images of several compounds.
Hi DOCK Blaster fans
I believe DOCK Blaster is working now. I am so sorry about the recent trouble.
I will go through all my mail as I continue testing for the next 24 hours. However, by far the simplest solution is to resubmit any job that has had trouble, and, if there is still trouble, then let me know again.
So, 24 hours of testing, and then I'll let you know if I still think it is fixed.
I will also reply to all the other questions about libraries etc.
It probably was on Saturday, while trying to introduce improvements. I am working assiduously to restore service today. Thank you for your patience.
Dear patient and kind DOCK Blaster users
Due to a typo pointing to a missing file, all the jobs submitted in the past two weeks or so have been hanging indefinitely. Obviously I need to do more testing when I start introducing new features to make sure the existing code still works. very sorry!
Please resubmit your jobs and let me know if you have any more problems.
I will be more careful going forward.
Dear docking.org fans:
Our server was down early Monday morning. Service resumed approximately 6:30am San Francisco time.
We are grateful to the alert and kind ZINC users who brought this to our attention while we were sleeping.
We plan to release a version of ZINC that supports InChI and InChIkeys this fall. In the meantime, here are some fun youtube videos about InChI.
1. What on Earth is InChI?
2. The Birth of the InChI
3. The Googlable InChIKey
4. InChI and the Islands
Dear DOCK Blaster users
I am making some changes to DOCK Blaster today and tomorrow (May 28 and 29). I'm trying as much as possible to make these invisible, but it is a live system. Thus I'm posting this warning. If things seem broken (more broken than usual!) please wait an hour and try again. If still not working, please write me, being as specific as possible, and I'll do what I can to put it back the way it was before.