Pinned Repositories
ADtoLDAP
A light weight Active Directory to OpenLDAP, or OpenLDAP to OpenLDAP Synchronization Connector written in Golang.
annlib
ANN: A Library for Approximate Nearest Neighbor Searching
augmented_memory
Augmented Memory and Beam Enumeration implementation
auto-sklearn
Automated Machine Learning with scikit-learn
CHEM101.6
ConfigSpace
dMaSIF
dockernel
Dockerized Jupyter kernels.
riccardosabatini's Repositories
riccardosabatini/annlib
ANN: A Library for Approximate Nearest Neighbor Searching
riccardosabatini/augmented_memory
Augmented Memory and Beam Enumeration implementation
riccardosabatini/auto-sklearn
Automated Machine Learning with scikit-learn
riccardosabatini/CHEM101.6
riccardosabatini/dMaSIF
riccardosabatini/dockernel
Dockerized Jupyter kernels.
riccardosabatini/espsim
Scoring of shape and ESP similarity with RDKit
riccardosabatini/FraGAT
FraGAT: a fragment-oriented multi-scale graph attention model for molecular property prediction
riccardosabatini/GeoPPI
riccardosabatini/grover
This is a Pytorch implementation of the paper: Self-Supervised Graph Transformer on Large-Scale Molecular Data
riccardosabatini/hr_demo_web
riccardosabatini/libcircllhist
A C implementation of Circonus log-linear histograms
riccardosabatini/masif_seed
Masif seed paper repository
riccardosabatini/MGSSL
Official implementation of NeurIPS'21 paper"Motif-based Graph Self-Supervised Learning for Molecular Property Prediction"
riccardosabatini/moka
riccardosabatini/molformer
Repository for MolFormer
riccardosabatini/ogb-lsc-pcqm4mv2
The OGB-LSC is the Large Scale Competition by Open Graph Benchmark to help accelerate research into machine learning on graph structured data
riccardosabatini/openfortivpn
Client for PPP+SSL VPN tunnel services
riccardosabatini/paper-qa
LLM Chain for answering questions from documents with citations
riccardosabatini/PARCE-1
PARCE version 1.0
riccardosabatini/PharmHGT
riccardosabatini/pharmit
Open-source online virtual screening tools for large databases
riccardosabatini/pHash
pHash - the open source perceptual hash library
riccardosabatini/pLannotate
Webserver and command line tool for annotating engineered plasmids
riccardosabatini/ProSmith
riccardosabatini/ProtTrans
ProtTrans is providing state of the art pretrained language models for proteins. ProtTrans was trained on thousands of GPUs from Summit and hundreds of Google TPUs using Transformers Models.
riccardosabatini/ScaffoldGraph
ScaffoldGraph is an open-source cheminformatics library, built using RDKit and NetworkX, for the generation and analysis of scaffold networks and scaffold trees.
riccardosabatini/SELFormer
SELFormer: Molecular Representation Learning via SELFIES Language Models
riccardosabatini/stable-diffusion
riccardosabatini/TankBind
Open source code for TankBind. Galixir Tenchnologies