Title: A geometric deep learning approach to predict binding conformations of bioactive molecules

DOI: https://doi.org/10.1038/s42256-021-00409-9

INFO: NATURE MACHINE INTELLIGENCE | VOL 3 | DECEMBER 2021

发表周期: Received: 18 May 2021; Accepted: 28 September 2021; Published online: 2 December 2021

药物设计是近年来AI应用的极火领域之一，其中一个最有挑战的问题就是空间结构设计。

One of the difficulties arises from the fact that only a small portion of the large chemical space will bind to a specific biological target and result in a therapeutic effect.

ER diagram Notation:

1. Chen Notation

2. Crow’s Foot Notation

3. UML Class Diagram Notation

Example MD

Problem Description

Fors some unknow reason, the user is unable to click the text boxes or type anything into the publish window after running the Build & Publish. When the user clicks the main window in Unity, the cursor disappears and the user can not select the text boxes or anything else.

This problem happens under my settings, macOS Catalina 10.15.7, Unity 2019.4.31f1, VRChat SDK3.

Solution

The reason of this problem is that when you click the temp scene created by the SDK3, the cursor will be invisible and locked.

1. Avticate your environment，check for package ipykernel

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python -m ipykernel --version

If it’s not installed：

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python -m pip install ipykernel

2. Add kernel to Jupyter notebook

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python -m ipykernel install --user --name 'kernelname'

3. Check Jupyter notebook kernel

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jupyter kernelspec list

4. Delet jupyter kernel

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jupyter kernelspec remove kernelname

Update 2022.09.25:

If you encounter the error: ImportError: cannot import name ‘AsyncGenerator’

Given a string s, find the length of the longest substring without repeating characters.

Example 1:

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2
3

Input: s = "abcabcbb"
Output: 3
Explanation: The answer is "abc", with the length of 3.

Example 2:

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3

Input: s = "bbbbb"
Output: 1
Explanation: The answer is "b", with the length of 1.

Example 3:

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4

Input: s = "pwwkew"
Output: 3
Explanation: The answer is "wke", with the length of 3.
Notice that the answer must be a substring, "pwke" is a subsequence and not a substring.

Example 4: