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Merge pull request #199 from asapdiscovery/add_software_outputs
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Add software as outputs category
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hmacdope authored May 30, 2024
2 parents 0be4863 + d43b401 commit 3190b66
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10 changes: 10 additions & 0 deletions content/outputs/software.md
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---
weight: 20
title: Software
description: Software produced by ASAP
toc: true
---

Software produced by ASAP.

{{< software >}}
50 changes: 50 additions & 0 deletions data/outputs/software.yaml
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asapdiscovery:
name: "asapdiscovery"
description: Monorepository for running computational chemistry project support for ASAP's viral targets, including docking, free energy calculations, chemoinformatics and machine learning.
permalink: http://asapdiscovery.org/outputs/software/#asapdiscovery
projects: [Project 5, Computational Chemistry Core]
links:
- name: GitHub
url: https://github.com/asapdiscovery/asapdiscovery
- name: Documentation
url: https://asapdiscovery.readthedocs.io/en/latest

choppa:
name: "choppa"
description: "A Python library for visualizing Deep Mutational Scanning data and other fitness data directly onto protein structures to enable fitness-informed decision-making in medicinal chemistry workflows in P2-P5 of ASAP's drug discovery pipeline."
permalink: http://asapdiscovery.org/outputs/software/#choppa
projects: [Project 1, Computational Chemistry Core]
links:
- name: GitHub
url: https://github.com/asapdiscovery/choppa
- name: Documentation
url: https://choppa.readthedocs.io

argos:
name: "argos"
description: "A web-based visualization tool for viewing DMS data on protein structures that allows users to generate and share these views using a web UI. See 'choppa' package below."
permalink: http://asapdiscovery.org/outputs/software/#argos
projects: [Project 2, Computational Chemistry Core]
links:
- name: GitHub
url: https://github.com/asapdiscovery/argos


hindsight:
name: "hindsight"
description: "Generates and continuously updates statistics and graphs comparing computational chemistry predictions with gathered experimental data to aid in hit-to-lead and lead optimization campaigns."
permalink: http://asapdiscovery.org/outputs/software/#hindsight
projects: [Project 5, Computational Chemistry Core]
links:
- name: GitHub
url: https://github.com/asapdiscovery/hindsight-public


falcbot:
name: "falcbot"
description: "A slack integration for running computational chemistry workflows that are developed by ASAP's computational chemistry core."
permalink: http://asapdiscovery.org/outputs/software/#falcbot
projects: [Project 5, Computational Chemistry Core]
links:
- name: GitHub
url: https://github.com/asapdiscovery/FALCBot
7 changes: 7 additions & 0 deletions themes/kube/layouts/shortcodes/software.html
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<!-- TODO: How should we sort the target data? -->
{{ range $package, $output := $.Site.Data.outputs.software }}

{{ $output := merge $output (dict "id" $package) }}
{{ partial "research-output.html" $output }}

{{ end }}

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