Pawansit

Passionate for analysis driven research for Multi-level Biological data understanding. More towards protein structural and small molecules analysis

Indian Biological Data Centre, IBDCFaridabad

Pinned Repositories

2d-pharmacophore-search
simple rdkit script
Language:Python00
AI_Curriculum
Open Deep Learning and Reinforcement Learning lectures from top Universities like Stanford, MIT, UC Berkeley.
0 1 00
AnnotatePDF
Search and color code the text in the PDF for better readability
Language:Python10
CATS2D
rdkit_cats2d
Language:Jupyter Notebook00
chemprop
Chemical Property Prediction with Graph Convolutional Networks
Language:Python00
Complete-Python-3-Bootcamp
Course Files for Complete Python 3 Bootcamp Course on Udemy
Language:Jupyter Notebook00
Cookbook
The Data Engineering Cookbook
0 1 00
descriptastorus
Descriptor computation(chemistry) and (optional) storage for machine learning
Language:Python00
LigandAnalysis
Jupyter Notebook for Chemical analysis
Language:Jupyter Notebook10
StructureAnalyst
Get the Short Macromolecular level Summary for mmCIF file.
Language:Python10

Pawansit's Repositories

Pawansit/AnnotatePDF
Search and color code the text in the PDF for better readability
Language:Python10
Pawansit/LigandAnalysis
Jupyter Notebook for Chemical analysis
Language:Jupyter Notebook10
Pawansit/StructureAnalyst
Get the Short Macromolecular level Summary for mmCIF file.
Language:Python10
Pawansit/AI_Curriculum
Open Deep Learning and Reinforcement Learning lectures from top Universities like Stanford, MIT, UC Berkeley.
0 1 00
Pawansit/CATS2D
rdkit_cats2d
Language:Jupyter Notebook00
Pawansit/Complete-Python-3-Bootcamp
Course Files for Complete Python 3 Bootcamp Course on Udemy
Language:Jupyter Notebook00
Pawansit/Cookbook
The Data Engineering Cookbook
0 1 00
Pawansit/descriptastorus
Descriptor computation(chemistry) and (optional) storage for machine learning
Language:Python00
Pawansit/Django-3-by-Example
Django 3 by Example, published by Packt
Language:Python0 1 00
Pawansit/Dynophore
Dynamic phormacophore from the protein binding site
Language:Perl00
Pawansit/handson-ml2
A series of Jupyter notebooks that walk you through the fundamentals of Machine Learning and Deep Learning in Python using Scikit-Learn, Keras and TensorFlow 2.
Pawansit/HBond-Alignment
Dynamic programming based Hydrogen Bond alignemnt between two protein conformaitons
Language:Python
Pawansit/HBond-dynamics
Language:Jupyter Notebook2 0
Pawansit/HomolWat
Program to incorporate internal water molecules to GPCR models
Language:Python1 0
Pawansit/Machine-Learning-Tutorials
machine learning and deep learning tutorials, articles and other resources
Pawansit/MicsProgramFile
Scripts for Ploting, database management and many more
Language:Perl
Pawansit/MolSim
first try of github
Pawansit/NeighborSearch
List neighboring Residues of selected Residue/Ligand in Protien Structure
Language:M4
Pawansit/pawansit.github.io
Language:HTML
Pawansit/plip
Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files according to 📝 Salentin et al. (2015), https://www.doi.org/10.1093/nar/gkv315
Pawansit/python-for-data-analysis
An introduction to data science using Python and Pandas with Jupyter notebooks
Pawansit/RISC
Language:C
Pawansit/Series4_PredictiveModel
Can we Predict Active Compounds in OSM Series 4?
Pawansit/StrucAnalysis
Script for structural Analysis
Language:Python
Pawansit/substrate-scope-plot
2
Pawansit/TeachOpenCADD
TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data
Pawansit/tsne-cuda
GPU Accelerated t-SNE for CUDA with Python bindings
Language:Cuda
Pawansit/vanddraabe
Identification and statistical analysis of structurally conserved waters via R
Language:HTML1 0
Pawansit/WaterDock-2.0
WaterDock-2.0 implementation with Akshay Sridhar
Pawansit/workshop