PolusAI / workflow-inference-compiler
A domain specific language for creating scientific pipelines
☆15Updated last week
Related projects: ⓘ
- A primer on statistical mechanics for biochemists☆45Updated 2 years ago
- BioEn - Bayesian Inference Of ENsembles☆16Updated 7 months ago
- Create macromolecular images☆29Updated 3 weeks ago
- ☆31Updated last month
- mmCIF Core Access Library☆31Updated last week
- Molecular Query Language☆29Updated 2 months ago
- Build hydrogen atoms from united-atom molecular dynamics of lipids and calculate the order parameters.☆14Updated last year
- Lab policies, training, style guides, etc.☆35Updated 5 months ago
- Quickly generate, start and analyze benchmarks for molecular dynamics simulations.☆75Updated 2 weeks ago
- Modeling molecular ensembles with scalable data structures and parallel computing☆33Updated last week
- The Integrative Modeling Platform☆72Updated this week
- Software for the prediction of FRET data from conformational ensembles.☆22Updated 2 weeks ago
- An implementation of the AWSEM coarse-grained protein folding forcefield in OpenMM☆32Updated last month
- Automated omics-scale protein modeling and simulation setup.☆52Updated 3 years ago
- Printing text using protein structures☆11Updated 3 years ago
- Najmanovich Research Group Toolkit for Elastic Networks☆10Updated last year
- ☆12Updated 2 weeks ago
- CHAP is a tool for the functional annotation of ion channel structures:☆18Updated 8 months ago
- PyMOL-wasm port's binary and html/javascript code☆17Updated 10 months ago
- ☆19Updated this week
- An extension to the MDAnalysis library providing support for dealing with structural ensembles. There is currently support for calculatin…☆13Updated 6 years ago
- Analyse Nucleic Acids Structure and Simulations with baRNAba☆37Updated 6 months ago
- Create molecular hashes☆26Updated 5 years ago
- Open Source Antibiotics Series 2☆10Updated last year
- The molstar plugin for plotly dash framework☆13Updated 3 weeks ago
- ☆15Updated 3 weeks ago
- Experimental small molecule hydration free energy dataset☆30Updated 2 years ago
- The MDAnalysis Toolkits Registry☆15Updated this week
- MD trajectory server☆36Updated last year
- Functions to scrape GPCR data from the web.☆16Updated 2 years ago