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Add workshops
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j-wags authored Sep 14, 2023
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2 changes: 1 addition & 1 deletion content/community/events/_index.md
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The Open Force Field Initiative organizes regular team meetings, webinars and workshops, both in person and virtual. Check our calendar for the upcoming events and see more information below about past and future events.
The Open Force Field Initiative organizes regular team meetings, webinars and workshops, both in person and virtual. See more information below about past and future events.
12 changes: 0 additions & 12 deletions content/community/events/event-calendar/_index.md

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title: 1st Open Force Field Workshop
description: The First Open Force Field Workshop was held in La Jolla, CA on January 7-8, 2019. The meeting was open to Consortium members and collaborators, and parts of the meeting were recorded for posting online. Watch the videos from this workshop on YouTube and access presentation slides on Zenodo.
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title: 2nd Open Force Field Workshop
description: We hosted the Second Open Force Field Workshop again in La Jolla, CA on August 30-31, 2019. The first two days of the workshop focused on the progress update and future planning of OpenFF efforts in Year 2. The workshop was extended for another day (Sep 1), which was reserved for OpenFF team discussions, but open to interested Industry Partners. The venue was provided by the Skaggs School of Pharmacy and Pharmaceutical Sciences at UCSD campus.
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title: 3rd Open Force Field Workshop
description: The Third Open Force Field Workshop was initially as an in-person gathering in Boston on May 4-5, 2020, but this meeting was cancelled due to the Covid-19 outbreak. This in-person meeting was replaced by a virtual meeting on the same dates. We decided to slightly experiment with the workshop format by making most of the content available before the meeting for asynchronous consumption.
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title: 4th Open Force Field Workshop
description: The 4th Open Force Field Workshop was held as a series of online presentations over several months in 2021.
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### June - September, 2021 | Online Workshop Series
These talks are available on our [YouTube Channel](https://youtube.com/playlist?list=PLYW6oF6nr8Nv4FsU7jZgF_qnbid2TQisr&si=SPsMwRzF4Ly8weuD).

## Keynote
June 11th, 2021

**Simon Boothroyd**

**David Mobley**

**Jeff Wagner**

(https://doi.org/10.5281/zenodo.4950029)

## Benchmarking
September 1st, 2021

**Lorenzo D'Amore** Large scale benchmarking of force fields in protein-ligand free energy calculations

(https://doi.org/10.5281/zenodo.5369857)

## Bespoke Fitting
September 8th, 2021

**Joshua Horton** Automated Bespoke Parameters for OpenFF

(https://doi.org/10.5281/zenodo.5495926)

<iframe width="560" height="315" src="https://www.youtube-nocookie.com/embed/videoseries?si=ILxRak1DSQjGEJ3l&amp;list=PLYW6oF6nr8Nv4FsU7jZgF_qnbid2TQisr" title="YouTube video player" frameborder="0" allow="accelerometer; autoplay; clipboard-write; encrypted-media; gyroscope; picture-in-picture; web-share" allowfullscreen></iframe>
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title: 5th Open Force Field Workshop
description: The 5th Open Force Field Workshop was held as a series of online presentations over several months in 2022.
foldopen: true
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### June - October, 2022 | Online Workshop Series
These talks are available on our [YouTube Channel](https://youtube.com/playlist?list=PLYW6oF6nr8NvEuaasDOcpZlQoy8NYsXDs&si=6BgwFhjraUXrFCzd)

## Keynote

June 28, 2022

**David Mobley**

**Jeff Wagner**

**Lily Wang**

**Diego Nolasco**

(https://doi.org/10.5281/zenodo.6774451)

## Interchange Showcase

**Matt Thompson** This session covers the current state of Interchange development and future plans. The example code explores the API points for creating, inspecting, modifying, combining, and exporting parameterized molecular systems using the new Interchange object, and shows examples of how Interchange can be tied into larger workflows.

(https://doi.org/10.5281/zenodo.7121172)
[Watch on YouTube](https://youtu.be/YA3PpeFFcqk?si=3PUbUlmSTNL6FVwP)

## Biopolymer Showcase
September 27, 2022

**Josh Mitchell** A session on biopolymer support in OpenFF Toolkit 0.11, showing advanced usage by parametrizing a protein with a post-translational modification (PTM). This workshop demonstrates loading and parametrizing biopolymers with the OpenFF Toolkit, including a preview of support for a non-canonical amino acid. We introduce the Toolkit's new biopolymer support, and then demonstrate a way to apply a post-translational modification. We look at optimizing charge generation by transferring charges generated from a simpler molecule to our new peptide, and then simulate it in OpenMM!

(https://doi.org/10.5281/zenodo.7307172)
[Watch on Youtube](https://www.youtube.com/watch?v=lZ4UUgHQpWg)

## BespokeFit Showcase
October 19th & 25th, 2022

**Josh Mitchell** An example session on using BespokeFit and incorporating it into your workflows. BespokeFit is an OpenFF package for automatically optimising torsion parameters for arbitrary small molecules. We present a worked example taking a ligand through optimization and simulation

(https://doi.org/10.5281/zenodo.7340156)
[Watch on YouTube](https://youtu.be/jI1t7QGir98)

<iframe width="560" height="315" src="https://www.youtube-nocookie.com/embed/videoseries?si=6BgwFhjraUXrFCzd&amp;list=PLYW6oF6nr8NvEuaasDOcpZlQoy8NYsXDs" title="YouTube video player" frameborder="0" allow="accelerometer; autoplay; clipboard-write; encrypted-media; gyroscope; picture-in-picture; web-share" allowfullscreen></iframe>
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title: 6th Open Force Field Workshop
description: The 6th Open Force Field Workshop was held as a part of the 2023 Open Molecular Software Foundation Symposium.
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### May 14, 2023 | part of the 2023 OMSF Symposium

These talks are available on our [YouTube Channel](https://youtube.com/playlist?list=PLYW6oF6nr8NuU1JeTHsMPaeYLYSjLhvSP&si=xXm23FMULpNWs5ob)

<iframe width="560" height="315" src="https://www.youtube-nocookie.com/embed/videoseries?si=XOLI03S0hrqZs1EF&amp;list=PLYW6oF6nr8NuU1JeTHsMPaeYLYSjLhvSP" title="YouTube video player" frameborder="0" allow="accelerometer; autoplay; clipboard-write; encrypted-media; gyroscope; picture-in-picture; web-share" allowfullscreen></iframe>

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