MolStart molecule viewer for transmembrane proteins http://molstar.org

Zepei Xu 30f72c4d85 Merge branch 'master' into mol2-2 há 7 anos atrás
.vscode 9cf93363eb Data model for tables and schema há 7 anos atrás
dist b12f11af03 renamed table to category, added File and Block classes, typed category and column objects há 7 anos atrás
docs 6d59213c9d Tweaks há 7 anos atrás
examples 8ff8156d0f Merge branch 'master' into mol2-2 há 7 anos atrás
src 30f72c4d85 Merge branch 'master' into mol2-2 há 7 anos atrás
.gitignore 07c3377ddb started with gro reader há 7 anos atrás
LICENSE a5405a509f Renamed to mol* há 7 anos atrás
README.md 135635ac06 Changed data model, updated GRO parser to handle velocities, arbitrary precision, multiple models há 7 anos atrás
molio.sublime-project 07c3377ddb started with gro reader há 7 anos atrás
package-lock.json 8d9604edf2 domain annotation server (prototype) há 7 anos atrás
package.json 8d9604edf2 domain annotation server (prototype) há 7 anos atrás
rollup.config.js 2693d26dae Added computation "model" há 7 anos atrás
tsconfig.json 4efaf1c28b Module refactoring há 7 anos atrás
tslint.json 0393a7e9b6 Tweaks há 7 anos atrás

README.md

License

  • general, non-opinionated library for reading and writing molecular structure related file formats
  • extending on the ideas of the CIFTools.js library

Building & Running

Build:

npm install
npm run build

Build automatically on file save:

npm run watch

Bundle with rollup (UMD and ES6)

npm run bundle

Make distribution files

npm run dist

Build everything above

npm run-script build && npm run-script bundle && npm run-script dist

Example script

Build

npm run script

Run

node ./build/js/script.js

TODO

  • write about unittest (AR)