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Create table for words and nouns. Query it when generating usernames
Reference: https://stackoverflow.com/questions/8674718/best-way-to-select-random-rows-postgresql
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Hello, I'm not sure how to use the command line 'bust -t file_table.csv' correctly.
What should the format of file_table.csv be like if I want to check numerous re-docked ligands?
Thank you in a…
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Hi,
Is it possible to use AMDock with PyMOL installed with macport on macOS 10.13.6? In this case pathway of PyMOL starting script is /opt/local/bin/pymol.
I've tried to compile pymol directly from …
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你好，对你们的对接程序很感兴趣，谢谢你发展了KarmaDock。看你们昨天发布的文章。比较好奇为什么你们不用equibind提供的time split划分做下模型训练来进行公平的比较呢？我清楚time split划分没意义，但是文章里提到不公平比较然后使用tankbind这一点似乎有点牵强了吧。是比不过他们，所以没放数据吗？你们的思路我以前实现过，就是用DeepDock那套打分以及构象优化（构象优…
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### Issue summary
I'm sorry to ask a naive question, I am just learning about docker as well. I got the gnina image from docker hub.
but I don't know how to run gnina from docker and do molecular d…
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For any questions relating to how/why/ ... Or anything you don't know where to ask.
For bug, suggestion, ... please open [seperate issue](https://github.com/arose/nglview/issues/new)
PS: QA-0: htt…
hainm updated
5 months ago
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### Week 1 - Get to know the community
- [x] Join the communication channels
- [x] Open a GitHub issue (this one!)
- [x] Install the Ersilia Model Hub and test the simplest model
- [x] Write a motiva…
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@MingyuanXu san
Hello. I'm interested in tree invent and am considering using it. I've been looking at the Activity_RL_example in the TreeInvent-Community. When incorporating a target property into…
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### Week 1 - Get to know the community
- [X] Join the communication channels
- [X] Open a GitHub issue (this one!)
- [x] Install the Ersilia Model Hub and test the simplest model
- [x] Write a m…
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### My Question is...
I am calculating gmx_MMPBSA for a protein (having two chains) and a ligand with two lone pairs in human system as well as in Plasmodium system. As per the requirements i have re…