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Sajeewa Pemasinghe
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  • About Me
  • Computational chemistry
  • Data Science with Python
    • Data wrangling
  • GUI programming
  • Research
    • Summary
    • Publications
  • Blog
  • Contact Me
  • Toggle website search

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Step by step guide for a local installation of WordPress

Read more about the article Step by step guide for a local installation of WordPress

Install a PHP, MySQL server like MAMP. Download WordPress from https://wordpress.org/download/ (gets downloaded as a zipped file). Extract the contents of the downloaded WordPress zipped file. Go inside the MAMP/htdocs folder…

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A python script to iteratively calculate center of mass from a gromacs .gro file

Read more about the article A python script to iteratively calculate center of mass from a gromacs  .gro file

Iteratively calculate COM By SAJEEWA PEMASINGHE You can download the python file here.

Continue ReadingA python script to iteratively calculate center of mass from a gromacs .gro file

Configuring GROMACS (patched with PLUMED) with GPU support in Linux

Read more about the article Configuring GROMACS (patched with PLUMED) with GPU support in Linux

GROMACS + PLUMED + GPU + LINUX By SAJEEWA PEMASINGHE System description CPU - Intel(R) Core(TM) i7-7500 @2.70 GHz GPU chip - NVIDIA GeForce 930MX OS - Ubuntu 16.04 LTS…

Continue ReadingConfiguring GROMACS (patched with PLUMED) with GPU support in Linux
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