<!DOCTYPE html PUBLIC "-//W3C//DTD HTML 4.0 Transitional//EN" "http://www.w3.org/TR/REC-html40/loose.dtd">
<html lang="en" style='--code-editor-font: var(--default-mono-font, "Menlo"), DejaVu Sans Mono, Liberation Mono, Consolas, Ubuntu Mono, Courier New, andale mono, lucida console, monospace;'>
<head>
<meta content="text/html; charset=US-ASCII" http-equiv="Content-Type">
<title>
GitLab
</title>

<style data-premailer="ignore" type="text/css">
a { color: #1068bf; }
</style>


<style>img {
max-width: 100%; height: auto;
}
body {
font-size: 0.875rem;
}
body {
-webkit-text-shadow: rgba(255,255,255,0.01) 0 0 1px;
}
body {
font-family: var(--default-regular-font, -apple-system),BlinkMacSystemFont,"Segoe UI",Roboto,"Noto Sans",Ubuntu,Cantarell,"Helvetica Neue",sans-serif,"Apple Color Emoji","Segoe UI Emoji","Segoe UI Symbol","Noto Color Emoji"; font-size: inherit;
}
</style>
</head>
<body style='font-size: inherit; -webkit-text-shadow: rgba(255,255,255,0.01) 0 0 1px; font-family: var(--default-regular-font, -apple-system),BlinkMacSystemFont,"Segoe UI",Roboto,"Noto Sans",Ubuntu,Cantarell,"Helvetica Neue",sans-serif,"Apple Color Emoji","Segoe UI Emoji","Segoe UI Symbol","Noto Color Emoji";'>
<div class="content">

<h3 style="margin-top: 20px; margin-bottom: 10px;">
Andreas Tille pushed to branch upstream at <a href="https://salsa.debian.org/med-team/autodock-vina">Debian Med / autodock-vina</a>
</h3>
<h4 style="margin-top: 10px; margin-bottom: 10px;">
Commits:
</h4>
<ul>
<li>
<strong style="font-weight: bold;"><a href="https://salsa.debian.org/med-team/autodock-vina/-/commit/75010d3e3b31d5dc602a1bd56cf9eb051732c4dc">75010d3e</a></strong>
<div>
<span> by Andreas Tille </span> <i> at 2023-09-12T13:09:47+02:00 </i>
</div>
<pre class="commit-message" style='white-space: pre-wrap; display: block; font-size: 0.875rem; color: #333238; position: relative; font-family: var(--default-mono-font, "Menlo"),"DejaVu Sans Mono","Liberation Mono","Consolas","Ubuntu Mono","Courier New","andale mono","lucida console",monospace; word-break: break-all; word-wrap: break-word; background-color: #fbfafd; border-radius: 2px; margin: 0; padding: 8px 12px; border: 1px solid #dcdcde;'>New upstream version 1.2.5</pre>
</li>
</ul>
<h4 style="margin-top: 10px; margin-bottom: 10px;">
30 changed files:
</h4>
<ul>
<li class="file-stats">
<a href="#0925b70eb313b43a854e6af466e46f8fbd262989">
.github/workflows/compile-binaries.yaml
</a>
</li>
<li class="file-stats">
<a href="#dd2d72e4efffa416a05f50db528c87f5ca4dea46">
.github/workflows/pypi-build.yml
</a>
</li>
<li class="file-stats">
<a href="#a5cc2925ca8258af241be7e5b0381edf30266302">
.gitignore
</a>
</li>
<li class="file-stats">
<a href="#8ec9a00bfd09b3190ac6b22251dbb1aa95a0579d">
README.md
</a>
</li>
<li class="file-stats">
<a href="#a665025f10eef2772071649de8adfb5168b73d17">
build/linux/debug/Makefile
</a>
</li>
<li class="file-stats">
<a href="#b33d9542bd7e7e71f1aa2d22f4ebd8bef74158dc">
build/linux/release/Makefile
</a>
</li>
<li class="file-stats">
<a href="#9ff95aa45d5da163cc4a4e7cc8c817eb1b960026">
build/mac/release/Makefile
</a>
</li>
<li class="file-stats">
<a href="#94076ec628ddc3edbb90e3e4913d25edf25e8ac1">
build/makefile_common
</a>
</li>
<li class="file-stats">
<a href="#833346a35684c6a758a676eefd4c8db3041618f7">
build/python/setup.py
</a>
</li>
<li class="file-stats">
<a href="#bcae07e6c482136708813daf264e0d5517d8472f">
build/python/vina/__init__.py
</a>
</li>
<li class="file-stats">
<a href="#1a88630e4a78445dd9285e9dc1a53dc64761b704">
build/python/vina/autodock_vina.i
</a>
</li>
<li class="file-stats">
<a href="#d081d29e1e2a1252df07277a49246022dbd19ce3">
<span class="deleted-file">

build/python/vina/autodock_vina_wrap.cpp
</span>
</a>
</li>
<li class="file-stats">
<a href="#72caae9897d0e170792a3332621c2f0670aeeed1">
build/python/vina/vina.py
</a>
</li>
<li class="file-stats">
<a href="#b950846768f86c692969b6fc9933d1318957a710">
<span class="deleted-file">

build/python/vina/vina_cli.py
</span>
</a>
</li>
<li class="file-stats">
<a href="#8a41d24c602ec0f31138afaefffc2b42abee9ad2">
<span class="deleted-file">

build/python/vina/vina_wrapper.py
</span>
</a>
</li>
<li class="file-stats">
<a href="#1dc762c9574af786a78d950cd0b58c99aceb371a">
build/windows/vina.vcxproj
</a>
</li>
<li class="file-stats">
<a href="#a649b9893a6e5432f8137f41af4821b89216371b">
build/windows/vina_split.vcxproj
</a>
</li>
<li class="file-stats">
<a href="#8f85ce531ea72b041e2ee1d8b748656e9613b7fa">
docs/source/docking_basic.rst
</a>
</li>
<li class="file-stats">
<a href="#68c01fb648539145fafedd593acf86a7b8cc2279">
docs/source/docking_hydrated.rst
</a>
</li>
<li class="file-stats">
<a href="#29a4c73534994135d451d1cf0d6cb1ebb4419a87">
docs/source/docking_macrocycle.rst
</a>
</li>
<li class="file-stats">
<a href="#9514bf5f7e14fbc07dc9f3c7bdba916cb0156c9f">
docs/source/docking_multiple_ligands.rst
</a>
</li>
<li class="file-stats">
<a href="#b571a52b889fc913cb7cd979479db1bb079845c2">
docs/source/docking_requirements.rst
</a>
</li>
<li class="file-stats">
<a href="#4798591a814a73af1bf094bfebb92a94bf1439ba">
docs/source/docking_zinc.rst
</a>
</li>
<li class="file-stats">
<a href="#2d9c0c62cdf7d42edd7e9a56b0879a0286f40f1c">
docs/source/installation.rst
</a>
</li>
<li class="file-stats">
<a href="#153470bc71e48dc039cd163cc3bf395ebbe1a592">
example/autodock_scripts/zinc_pseudo.py
</a>
</li>
<li class="file-stats">
<a href="#62a239148ad5019003528c5cc714243dd079535c">
example/basic_docking/data/1iep_ligand.sdf
</a>
</li>
<li class="file-stats">
<a href="#2b3c611091f1494b8f15e1e84153f1058c56c131">
example/docking_with_zinc_metalloproteins/data/1s63_ligand.sdf
</a>
</li>
<li class="file-stats">
<a href="#f19127c53721bf8fdca02d22b7a37b3bbfd5b2c4">
src/lib/cache.cpp
</a>
</li>
<li class="file-stats">
<a href="#bbd4e8681b43b34c6209e6af463330d50e667f70">
src/lib/model.cpp
</a>
</li>
<li class="file-stats">
<a href="#9f03731fb1d0493f9be5593e256743783f3cc467">
src/lib/model.h
</a>
</li>
</ul>
<h5 style="margin-top: 10px; margin-bottom: 10px; font-size: 0.875rem;">
The diff was not included because it is too large.
</h5>

</div>
<div class="footer" style="margin-top: 10px;">
<p style="font-size: small; color: #737278;">

<br>
<a href="https://salsa.debian.org/med-team/autodock-vina/-/commit/75010d3e3b31d5dc602a1bd56cf9eb051732c4dc">View it on GitLab</a>.
<br>
You're receiving this email because of your account on <a target="_blank" rel="noopener noreferrer" href="https://salsa.debian.org">salsa.debian.org</a>. <a href="https://salsa.debian.org/-/profile/notifications" target="_blank" rel="noopener noreferrer" class="mng-notif-link">Manage all notifications</a> · <a href="https://salsa.debian.org/help" target="_blank" rel="noopener noreferrer" class="help-link">Help</a>
<script type="application/ld+json">{"@context":"http://schema.org","@type":"EmailMessage","action":{"@type":"ViewAction","name":"View Commit","url":"https://salsa.debian.org/med-team/autodock-vina/-/commit/75010d3e3b31d5dc602a1bd56cf9eb051732c4dc"}}</script>


</p>
</div>
</body>
</html>