ccsb-scripps / AutoDock-Vina

AutoDock Vina
http://vina.scripps.edu
Apache License 2.0
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1.2.3 installers for Mac and Linux are not archives #127

Closed mishaguy closed 2 years ago

mishaguy commented 2 years ago

Hello,

When I download 1.23 for Mac and Linux from https://github.com/ccsb-scripps/AutoDock-Vina/releases, files come without tgz extensions. Adding tgz or tar.gz to file does not allow to open archive with tar. How to use these installers?

Thanks, Misha

mishaguy commented 2 years ago

I found out how to open it thanks

mishaguy commented 2 years ago

Sorry, I thought I figured it out by adding gz but clicking on Mac just makes it cpgz. How to open these files? thanks

diogomart commented 2 years ago

Hi. They are not installers. These files are meant to be executed in the command line.

mishaguy commented 2 years ago

Hi Diogo,

Thanks for this.

Can I ask you not related question? Do you know if there is MGL Tools compiled for Catalina, and higher? For 64 bit Mac.

Best, Misha

Mikhael Guy Research Scientist Science Research Software Core Yale Center for Research Computing Yale University P.O. Box 208107 Sterling Chemistry Laboratory 225 Prospect Street, Rm. 154 New Haven, CT 06520 203.436.8599 For questions related to scientific, analytical and computational software, please e-mail at @.**@.>

On Aug 9, 2022, at 1:09 AM, Diogo @.**@.>> wrote:

Hi. They are not installers. These files are meant to be executed in the command line.

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diogomart commented 2 years ago

MGLTools is a collection of tools, I don't know if they all work on Catalina, sorry. The autodock mailing list might know: https://autodocksuite.scripps.edu/support/

RomuloBarrosPI commented 2 years ago

@diogomart , using Mac M1 and download the vina_1.2.2_macos_arm64 release, but I can't use it as an executable. Please, am I maybe forgetting something?

diogomart commented 2 years ago

@RomuloBarrosPI what error do you get?

RomuloBarrosPI commented 2 years ago

@RomuloBarrosPI what error do you get?

@diogomart , thanks so much for your attention.

I get an error message saying there is no application set to opening the document “vina_1.2.2_macos_arm64”.

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So it is like mac is seeing it as a simple document and not as an executable file.

diogomart commented 2 years ago

You need to run it from the command line, i.e. ./vina_1.2.2_macos_arm64. You may need to give permission to execute with the chmod command. If you are not familiar with the command line, this linux tutorial may help.

RomuloBarrosPI commented 2 years ago

This is just awesome. It almost did it!

I typed this:chmod 777 ./vina_1.2.2_macos_arm64, and then ./vina_1.2.2_macos_arm64. Had to tweak Mac's System Secutiry & Privacy to allow it to run.

It ran, but I got this error: '/usr/local/lib/libboost_system.dylib' (no such file)

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I gonna keep trying.

RomuloBarrosPI commented 2 years ago

Wow!! Got it @diogomart !

just running brew install boost did the job!

Thank you so much for your help! This may also help others with the same problem on a Mac M1 and M2 processors.

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diogomart commented 2 years ago

Awesome!