Becksteinlab / making-prettier-plotsLinks
a quick primer on making prettier (and more impactful) plots
☆14Updated 9 years ago
Alternatives and similar repositories for making-prettier-plots
Users that are interested in making-prettier-plots are comparing it to the libraries listed below
Sorting:
- Python bindings for TNG file format☆13Updated 8 months ago
- Materials for the 2021 PRACE Workshop @ SurfSARA☆30Updated 3 years ago
- Quickly generate, start and analyze benchmarks for molecular dynamics simulations.☆79Updated 10 months ago
- Fast PBC wrapping and unwrapping for VMD☆23Updated 7 months ago
- Physical validation of molecular simulations☆56Updated last week
- Main code repository for FATSLiM☆21Updated 3 years ago
- A Python toolkit for the analyis of lipid membrane simulations☆31Updated last month
- Dihedral scanner with wavefront propagation☆34Updated 2 months ago
- A general small molecule force field descended from AMBER99 and parm@Frosst, available in the SMIRNOFF format☆29Updated 10 months ago
- RESP with inter- and intra-molecular constraints in Psi4.☆32Updated 2 years ago
- The MDAnalysis Toolkits Registry☆18Updated this week
- Advanced toolkit for binding free energy calculations☆32Updated last month
- Recipes and protocols for molecular free energy calculations using the openmmtools/perses and Open Free Energy toolkits☆14Updated this week
- Bayesian tools for fitting molecular mechanics torsion parameters to quantum chemical data.☆21Updated 3 years ago
- Dynamic Histogram Analysis To Determine Free Energies and Rates from Biased Simulations☆20Updated 7 years ago
- A command line application to launch molecular dynamics simulations with OpenMM☆40Updated 3 years ago
- Package for consistent reporting of relative free energy results☆39Updated last month
- Density based object completion over PBC.☆30Updated 7 months ago
- Reads Gromacs EDR file to populate a pandas dataframe☆33Updated 8 months ago
- Best Practices article intended for LiveCoMS☆41Updated 5 years ago
- Calculation of water/solvent partition coefficients with Gromacs.☆28Updated 9 months ago
- ☆25Updated 3 years ago
- Generate coarse-grained molecular dynamics models from atomistic trajectories.☆64Updated 2 years ago
- Parallel algorithms for MDAnalysis☆31Updated 11 months ago
- User Guide for MDAnalysis☆27Updated 2 months ago
- Real time monitoring and visualization of Amber MD simulations☆15Updated 5 years ago
- the simple alchemistry test set☆9Updated 6 months ago
- Lab policies, training, style guides, etc.☆35Updated last year
- Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.☆70Updated last week
- Data generation and submission scripts for the QCArchive ecosystem.☆35Updated last week