ghorbanimahdi73 Goto Github PK

3dlinker

An E(3) Equivariant Variational Autoencoder for Molecular Linker Design

allostery-nri

code for learning allosteric point-to-point communication in protein dynamics using an efficient Neural relational inference

ampgen

Attention based variational auto encoder for antimicrobial peptide generation

autofragdiff

awesome-machine-learning

A curated list of awesome Machine Learning frameworks, libraries and software.

chemcpa

Code for "Predicting Cellular Responses to Novel Drug Perturbations at a Single-Cell Resolution", NeurIPS 2022.

deeptime

Python library for analysis of time series data including dimensionality reduction, clustering, and Markov model estimation

diffsbdd

A Euclidean diffusion model for structure-based drug design.

ghorbanimahdi73.github.io

My personal website

gmvae-md

graphvampnet

linking

siamese-triplet

Siamese and triplet networks with online pair/triplet mining in PyTorch