Code Monkey home page Code Monkey logo

matlab_nmrdatacomparison's Introduction

MatLab_NMRdatacomparison-

MatLab scripts for overlaying and marking matched signals for HSQC NMR compound identification. Entries are based on experimental NMR data (1H and 13C) organized following a template as .txt file.

% DataBase for Construction and Comparison % Rules for the dataBASE txt files: % first line: name of the compound % second line: SMILES structure % third line: Molecular Weight % forth line: Heads(Number 1H 13C ...) % fifth line: data (number(position) 1Hdata 13Cdata)

%Requirements from experimental data of a mixture % ppm1: 1H experimental axis % ppm2: 13C experimental axis % functions: importHCdataNumber importHCdataDB simulateHSQC_2D semiAutoMatchHSQC

% Workflow designed by Ricardo M Borges (10-16-2018)

Recommend Projects

  • React photo React

    A declarative, efficient, and flexible JavaScript library for building user interfaces.

  • Vue.js photo Vue.js

    🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.

  • Typescript photo Typescript

    TypeScript is a superset of JavaScript that compiles to clean JavaScript output.

  • TensorFlow photo TensorFlow

    An Open Source Machine Learning Framework for Everyone

  • Django photo Django

    The Web framework for perfectionists with deadlines.

  • D3 photo D3

    Bring data to life with SVG, Canvas and HTML. 📊📈🎉

Recommend Topics

  • javascript

    JavaScript (JS) is a lightweight interpreted programming language with first-class functions.

  • web

    Some thing interesting about web. New door for the world.

  • server

    A server is a program made to process requests and deliver data to clients.

  • Machine learning

    Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.

  • Game

    Some thing interesting about game, make everyone happy.

Recommend Org

  • Facebook photo Facebook

    We are working to build community through open source technology. NB: members must have two-factor auth.

  • Microsoft photo Microsoft

    Open source projects and samples from Microsoft.

  • Google photo Google

    Google ❤️ Open Source for everyone.

  • D3 photo D3

    Data-Driven Documents codes.