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

Aborescence: a5405a509f
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TmMolStar
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David Sehnal a5405a509f Renamed to mol* il y a 7 ans
.vscode 9cf93363eb Data model for tables and schema il y a 7 ans
dist b12f11af03 renamed table to category, added File and Block classes, typed category and column objects il y a 7 ans
docs 6d59213c9d Tweaks il y a 7 ans
examples 780462e8ea multimodel parsing il y a 7 ans
src a5405a509f Renamed to mol* il y a 7 ans
.gitignore 07c3377ddb started with gro reader il y a 7 ans
LICENSE a5405a509f Renamed to mol* il y a 7 ans
README.md 135635ac06 Changed data model, updated GRO parser to handle velocities, arbitrary precision, multiple models il y a 7 ans
molio.sublime-project 07c3377ddb started with gro reader il y a 7 ans
package-lock.json b50dbbc2e5 Updated to TS 2.6 il y a 7 ans
package.json a5405a509f Renamed to mol* il y a 7 ans
rollup.config.js 2693d26dae Added computation "model" il y a 7 ans
tsconfig.json dbf67afdce Fixed module resolution (no more ../../../../../) il y a 7 ans
tslint.json 07c3377ddb started with gro reader il y a 7 ans

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)