Pinned Repositories
Aggregation-Automation
The purpose of these scripts is to automate the generation of files necessary for all-atom molecular dynamics simulation of multiple copies of a mutant of a peptide.
Analysis-Scripts
This is a repository for the analysis scripts I commonly use for my PhD research.
chitrakgupta.github.io
Clustering-Parallelized
The purpose here is to create a 4-dimensioal vector by merging two data files, and then perform clustering on it. K-medoids clustering is robust to outliers, so this one is being chosen. Since the number of cluster is unknown, silhouette function is being used to estimate to "goodness" of clsutering
Data-Science-Course
Intelligent_NAMD
Developmental scripts for intelligent NAMD
IntermediatePythonWorkshop
Intermediate Python Workshop
Planets
Sample-Jekyll-Site
A simplistic site for Jekyll
CryoFold_GUI
chitrakgupta's Repositories
chitrakgupta/Analysis-Scripts
This is a repository for the analysis scripts I commonly use for my PhD research.
chitrakgupta/Intelligent_NAMD
Developmental scripts for intelligent NAMD
chitrakgupta/Aggregation-Automation
The purpose of these scripts is to automate the generation of files necessary for all-atom molecular dynamics simulation of multiple copies of a mutant of a peptide.
chitrakgupta/chitrakgupta.github.io
chitrakgupta/Clustering-Parallelized
The purpose here is to create a 4-dimensioal vector by merging two data files, and then perform clustering on it. K-medoids clustering is robust to outliers, so this one is being chosen. Since the number of cluster is unknown, silhouette function is being used to estimate to "goodness" of clsutering
chitrakgupta/Data-Science-Course
chitrakgupta/IntermediatePythonWorkshop
Intermediate Python Workshop
chitrakgupta/Planets
chitrakgupta/Sample-Jekyll-Site
A simplistic site for Jekyll