Thiliban Manivarma's Projects
Deploying ML Model
Here I used neural network to find the hotspots residues in the protein complex, 15LOX1/PEBP1 which is responsible for Ferroptosis ( Programmed cell death ).
Here I tried finding a few potential inhibitors of 15LOX1 which is one of the mediators of ferroptosis.
Being a researcher with the background of Pharmaceutical technology and Computational biology, this part of repository will have more problem statements and tackling approaches towards Drug design, Computational Chemistry, Structural bioinformatics and other biological oriented area!
Here you could find all of my fun and real world problems using Machine learning and Artificial Intelligence.
Having an enormous interest on Molecular modeling and Computer-aided-drug-design, this repository is going to be filled with Molecular docking, Molecular dynamics simulation (Molecular Mechanics, Quantum Mechanics ), Structure based drug design, Ligand based drug design, Free energy calculation, Different Force field parameters calculation and many many more. I will be highly looking forward to code and share with you all! Happie learning.
This repository will have more intense and neat structured python codes! All the codes here are bit higher range like even a simple problems would be having OOPS, functions, etc! I am trying my best!
This repository is a python library that provides functions to deal with prime numbers.
A Python Package for Protein Dynamics Analysis
This is a repository which contains the files I prepared while learning of python since 2019 and files might contain my own comments inside the jupyter notebooks, please understand my old self.
Its all about python to make our life easier!
I'll be focusing on small molecules that target the 15LOX-1 protein using RDKit.
This repository will be having more and more codes to solve the drug discovery problem statements.