jmbuhr / quarto-molstar
Shortcode to embed proteins and trajectories with Mol*
☆45Updated last year
Alternatives and similar repositories for quarto-molstar:
Users that are interested in quarto-molstar are comparing it to the libraries listed below
- Integrating R and the CDK☆43Updated last year
- Various Cheminformatic, Curation and Mass Spectrometry Functions☆13Updated 4 years ago
- R-based access to Mass-Spectrometry data☆24Updated 4 months ago
- 💊 Molecular informatics toolkit with integration of bioinformatics and cheminformatics tools for drug discovery☆37Updated 7 months ago
- Toolset for the reproducible analysis of chromatography data in R (HPLC-DAD/UV, GC-FID).☆18Updated 2 weeks ago
- A mirror of official bio3d development site at Bitbucket: https://bitbucket.org/Grantlab/bio3d. See also bio3d website: http://thegrantl…☆23Updated 2 years ago
- 🧬 An R package for visualizing molecular data in 3D☆90Updated last year
- Cheminformatics Toolkit for R☆16Updated last month
- A pragmatic interface to RDKit in R☆25Updated 5 years ago
- Parsers for chromatography data in R (HPLC-DAD/UV, GC-FID, MS)☆35Updated 2 weeks ago
- Compile Mass Spectral Libraries from Various Sources☆17Updated last year
- ☆13Updated 7 years ago
- These workshops and tutorials provide use cases and examples for mass spectrometry data handling and analysis using the Spectra Bioconduc…☆20Updated 9 months ago
- US EPA's Toxicity Forecaster (ToxCast) Pipeline. More information on the ToxCast program available here: https://www.epa.gov/comptox-tool…☆36Updated this week
- US EPA's Toxicity Reference Database (ToxRefDB)☆21Updated 2 years ago
- R Interface to the ClassyFire REST API☆10Updated 2 months ago
- Workflow solutions for mass-spectrometry based non-target analysis.☆65Updated last week
- 🧬 Toolkit for generating various numerical features of protein sequences☆52Updated 7 months ago
- ☆36Updated 6 months ago
- An Online Tool for the Real-Time Kinetic Analysis of Binding Events☆14Updated last month
- chemmodlab: A Cheminformatics Modeling Laboratory for Fitting and Assessing Machine Learning Models☆16Updated last year
- OpenBabel wrapper package for R☆10Updated 9 months ago
- An R package framework for accessing biological and chemical databases and developing or extending new connectors.☆11Updated 2 years ago
- ☆28Updated 2 years ago
- A generic mechanism for describing views used in molecular visualizations☆30Updated 2 weeks ago
- Link molecular structures of chemicals (in form of topological fingerprints) with multiple targets☆10Updated 4 months ago
- An R package to calculate indices and theoretical physicochemical properties of peptides and protein sequences.☆85Updated last year
- Metabolome Annotation Workflow☆25Updated last year
- ☆10Updated last year
- Graph-based community clustering approach to extract protein domains from a predicted aligned error matrix☆35Updated 2 years ago