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Category: Macinchem Blog

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Macinchem Blog Science Apps

Vienna Ab initio Simulation Package (VASP) on Apple Silicon

17 March 20238 June 2023 chris

The Vienna Ab initio Simulation Package, better known as VASP, has been compiled on Apple Silicon. The instructions can be found on GitHub https://gist.github.com/janosh/a484f3842b600b60cd575440e99455c0 The

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Macinchem Blog Science Apps

ChimeraX 1.5

16 March 20235 May 2023 chris

Available for download https://www.rbvi.ucsf.edu/chimerax/download.html Open the downloaded DMG file and drag ChimeraX to your Applications folder. Includes native versions for M2, M1 and Intel Macs.

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Data Analysis Tools Macinchem Blog Science Apps

Gephi 0.10 released

16 March 202321 June 2023 chris

Gephi 0.10.0 is here! Download it from https://gephi.org, now supports Apple Silicon, It loads much faster and complex operations such as layouts run smoother. Gephi is

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Data Analysis Tools Macinchem Blog Science Apps

pro Fit data analysis

16 March 202325 May 2023 chris

pro Fit, a macOS application for curve fitting (linear and nonlinear regression), plotting, and data analysis for macOS. It runs natively on both Apple Silicon

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Macinchem Blog

Sheffield 9th Conference on Cheminformatics 

16 March 202322 May 2023 chris

The Sheffield Conference on Cheminformatics is always one of the highlights of the calendar, it will be held at The Edge, University of Sheffield, UK,

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Data Analysis Tools Macinchem Blog Science Apps Spectroscopy

MZmine is an open-source project for mass-spectrometry data processing

8 March 202325 May 2023 chris

Just came across this project, MZmine is an open-source project delivering a graphical, interactive software for mass-spectrometry data processing. Available on GitHub https://github.com/mzmine

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Data Analysis Tools Macinchem Blog Science Apps

StarDrop Updated

7 March 20235 May 2023 chris

StarDrop 7.4. This latest release contains several new features. https://optibrium.com/downloads/StarDrop%207.4%20Quick%20Start%20Guide.pdf Core Application​: * Added the ability to colour StarDrop data sets based on property values

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Macinchem Blog Reviews Science Apps Software Reviews

ChemDoodle Review

4 March 202311 May 2023 chris

ChemDoodle 3.0 from iChemLabs is the latest update of a chemical drawing package that also provides for support for many other types of chemical data such

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Hints and Tutorials Macinchem Blog Reviews Software Reviews

ChemDoodle Web Components

4 March 202312 April 2023 chris

Introduction and Background ChemDoodle Web Components are pure javascript objects derived from ChemDoodle™ to solve common chemistry related tasks on the web. These components are powerful,

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Macinchem Blog

InChi Survey

4 March 202331 July 2023 chris

The InChi group are running a short survey to find out more about the use. It would be really helpful if you have 2-3 mins

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  • View post by on Bluesky

    @macinchem.bsky.social 5 days

    RSC CICAG Distillate Now Available

    The Summer 2026 edition of the CICAG Distillate has been published and can be downloaded from the CICAG website http://www.rsccicag.org/newsletters.htm. This CICAG Distillate...

    https://macinchem.org/2026/07/17/rsc-cicag-distillate-now-available/
  • View post by on Bluesky

    @macinchem.bsky.social 1 week

    Stacks:- Run classic HyperCard stacks on modern macOS

    Someone just sent me this link, and it brings back many memories. Anyone else remember HyperCard? https://morphing.cloud/hypercard FEATURES Run...

    https://macinchem.org/2026/07/13/stacks-run-classic-hypercard-stacks-on-modern-macos/
  • View post by on Bluesky

    @macinchem.bsky.social 2 weeks

    ChemScribble, hand draw chemical structures

    There have been a couple of attempts to create an application that allows users to hand draw chemical structures. Some rely on chemical structure recognition to convert...
  • View post by on Bluesky

    @macinchem.bsky.social 3 weeks

    Claude Science, an AI workbench for scientists, is now available

    Anthropic have released Claud Science, Claude Science brings fragmented tools that require specific file formats and Jupyter, R...

    https://macinchem.org/2026/07/01/claude-science-an-ai-workbench-for-scientists-is-now-available/
  • View post by on Bluesky

    @macinchem.bsky.social 3 weeks

    RSC CICAG Quantum Computing in Chemistry: Current Capabilities and the Road to Utility

    Registration for the Quantum Computing in Chemistry meeting is now open. It will be...
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