8000 devashishdas (Devashish Das) / Starred · GitHub
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Abdelazim-Abdelgawwad / easyPARM

easyPARM is a computational tool developed to simplify the derivation of force field parameters for metal-containing molecular systems and to enable charge restraints on specific atoms.

Python 19 1 Updated Jul 2, 2025

devashishdas / NeuralPDB

Everything with Protein PDB

Python 1 Updated Sep 5, 2023

shirtsgroup / InterMol

Conversion tool for molecular simulations

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rounakvjay / Protein_Sequence_Classification

A case study on Pfam dataset to classify protein families.

Jupyter Notebook 32 16 Updated Oct 10, 2019

DinaKlim / Alexey-Grigoriev-s-ML-Zoomcamp-Homework

Python 3 1 Updated Nov 8, 2021

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Learn ML engineering for free in 4 months!

Jupyter Notebook 10,529 2,470 Updated Mar 4, 2025

BaderLab / SocialNetworkApp

dropbox

Java 7 4 Updated Feb 24, 2023
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