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Tag: virtual screening

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Parallel docking using EasyDock

5 November 20235 November 2023 chris

As virtual libraries get ever larger the challenges of virtual screening get larger. Whilst docking into a target protein is a very popular and successful

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Macinchem Blog Science Apps

Lig3DLens An open source ligand-based 3D virtual screening toolbox from Healx

14 October 202314 October 2023 chris

Whilst there are a number of proprietary applications for virtual screening there are few open-source alternatives. Whilst most of the functionality needed is available in

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Reviews Science Apps Software Reviews

A Review of LigandScout

13 March 202318 May 2023 chris

LigandScout from inte:ligand is a software tool that allows to rapidly and transparently derive 3D pharmacophores from structural data of macromolecule/ligand complexes in a fully automated and

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Avatar RSC BMCS @rsc_bmcs ·
27 Nov

Announcing our 6th and final speaker for RSC-BMCS Hot Topics 2023!

@disney_lab from @UFScripps, speaking on 'Design of Bioactive Small Molecules Targeting RNA'.

Register in the next 2 DAYS to watch this talk live👉 https://www.eventsforce.net/hg3/260/register

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Avatar RSC BMCS @rsc_bmcs ·
24 Nov

Announcing our 5th speaker for RSC-BMCS Hot Topics 2023!

@rabiatkhan from @serna_bio, speaking on 'Opportunities and challenges in small molecules targeting RNA - do we need a new tool kit?'

Click here to register before 29th of November👉https://www.eventsforce.net/hg3/frontend/reg/thome.csp?pageID=101159&eventID=260

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Avatar Chris Swain @macinchem ·
23 Nov

Mnova 15.0 released https://macinchem.org/2023/11/23/mnova-15-0-released/

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Avatar RSC BMCS @rsc_bmcs ·
22 Nov

Announcing our third speaker for RSC-BMCS Hot Topics: Targeting RNA 2023!

@OlallaLab from Philipps-University Marburg, speaking on 'Controlling gene expression with light: photoswitches for mRNA splicing'

There's still time to register! Click here👉https://www.eventsforce.net/hg3/frontend/reg/thome.csp?pageID=101159&eventID=260&CSPCHD=0020010000000KmPxQsnQm8aqAgGAyxBW1tzhFKqx4EbNP39Mg

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