pymod | PyMod 3 - sequence similarity searches | Genomics library
kandi X-RAY | pymod Summary
kandi X-RAY | pymod Summary
PyMod 3 is an open source PyMOL plugin, designed to act as an interface between PyMOL and several bioinformatics tools (for example: BLAST+, HMMER, Clustal Omega, MUSCLE, PSIPRED and MODELLER). The current PyMod release, PyMod 3, is compatible with the most recent PyMOL versions (see the Requirements section below) and has been extended with new functionalities with respect to its predecessor (PyMod 2). Starting from the amino acid sequence of a target protein, users may take advantage of PyMod 3 to carry out the three steps of the homology modeling process (that is, template searching, target-template sequence alignment and model building) in order to build a 3D atomic model of a target protein (or protein complex). Additionally, PyMod 3 may also be used outside the homology modeling context, in order to extend PyMOL with numerous types of functionalities. Sequence similarity searches, multiple sequence/structure alignment building, evolutionary conservation analyses, domain parsing and loop modeling can be performed in the PyMod 3/PyMOL environment.
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Top functions reviewed by kandi - BETA
- Launch Modeller .
- Generate an isosurface .
- Generate draw specifications for this item .
- Create the main menu .
- Gets the state of the matrix .
- Initialize the shader program .
- Check if PyMod .
- Perform qblast search .
- Generate an Isocurve .
- Move the handle to the given position .
pymod Key Features
pymod Examples and Code Snippets
Community Discussions
Trending Discussions on pymod
QUESTION
fist Post as i normaly find the answers if i search long enough. But today is the day... I bought a EnergyMeter from Aliexpress with MODBUS RTU connection and im trying to read it out. I already tried a lot of stuff from all over the Internet.
This is the Datasheet of the EnergyMeter1
I tried pyModbus and minimalmodbus.
My both Scripts:
...ANSWER
Answered 2021-May-14 at 13:08Thanks to @Brits i got it running.
I had to use read_float(0, functioncode=4, number_of_registers=2)
where 0 is decimal.
If i want to read 001A i had to convert from hex to dec = 26.
Works very good
QUESTION
I'm trying to use some modules from pyModeS
in columns of a pandas data frame.
The data frame in question is this one:
...ANSWER
Answered 2021-Mar-17 at 12:24Use custom function, unfortunately performance depends of pms
module processing:
QUESTION
Ok, I stripped the code to ultra minimal to illustrate the problem and make it reproducible
context :
- Python 3.7
- No VENV or funny stuff
Talk is cheap. Show you the code :
code structure :
...ANSWER
Answered 2020-Sep-16 at 11:36Once you have a package-like directory structure, run python with the -m
option to run a module as a script:
QUESTION
Note: Since asking this question, I discovered later on that python -m pip install -e .
will install the extension to cmod
with .venv/lib/python3.8/site-packages/hello-c-extension.egg-link
pointing to the project in the current directory. I've also switched to a src
layout in later commits and have found https://pythonwheels.com/ to be a great reference for high-quality packages that distribute wheels. However, I'm still curious to know about the behavior of setup.py
subcommands.
As part of some research on manylinux, I am using a toy project to build different platform wheels for a C++ extension module.
It seems that when building and installing locally, I cannot import the C++ extension module if my current directory is the project root directory. This prevents me from running unit tests, among other things. I believe the reason for this is that .
becomes the first component of sys.path
, and so the pure-Python version is picked up while the compiled extension is not.
How can I fix this? Am I running the local build/install correctly?
The package structure looks like this:
...ANSWER
Answered 2020-Apr-07 at 07:50Is this really ... how it's supposed to work? What would be the proper way to run unit tests for the extension module in this case?
Python imports from sys.path
. This means that it will search each and every directory for the import, from index 0
through to the last item in sys.path
.
Note that a hacky approach to a fix would be to add the following before the import: sys.path.append(sys.path.pop(0))
. This still allows local imports, but means that site-packages
and the standard library are searched first.
How can I fix this? Am I running the local build/install correctly?
I'll answer the first question below.
Yes, your build/install is fine, but to fix the import problem, you'll need to tweak it slightly.
Fixing the problemSwitch to the src/cmod
layout. A great link - which is pointed out by yourself in the questions comments - is here.
This approach is discussed in the comments, and since asking the question you've actually implemented this. (60093f1).
I'll now quote some of that article; it explains this better than I could.
The src directory is a better approach because:
- You get import parity. The current directory is implicitly included in sys.path; but not so when installing & importing from site-packages. Users will never have the same current working directory as you do.
This constraint has beneficial implications in both testing and packaging:
You will be forced to test the installed code (e.g.: by installing in a virtualenv). This will ensure that the deployed code works (it's packaged correctly) - otherwise your tests will fail. Early. Before you can publish a broken distribution.
You will be forced to install the distribution. If you ever uploaded a distribution on PyPI with missing modules or broken dependencies it's because you didn't test the installation. Just beeing able to successfuly build the sdist doesn't guarantee it will actually install!
And pip install -e .
will no longer mess stuff up.
Community Discussions, Code Snippets contain sources that include Stack Exchange Network
Vulnerabilities
No vulnerabilities reported
Install pymod
Please refer to the PyMod 3 User's Guide to learn how to install PyMod 3 on your system. Long story short: PyMod 3 can be installed as any other PyMOL plugin. Download the PyMod 3 plugin file (a ZIP file named pymod3.zip, see the link above) and use the PyMOL plugin manager (Plugin -> Plugin Manager from the menu of its main window) to install it. The external tools of PyMod 3 can be obtained and configured through an easy-to-use installer dialog which can be launched by the plugin (Help -> Install PyMod Components from the main menu of the plugin). The way to configure MODELLER in PyMod may vary according to your PyMOL version (in the User's Guide we cover different scenarios).
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