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ocsr-project

Optical Chemical Structure Recognition Tool (based on OSRA)

ocsr_review

This repository contains the information related to the benchmark study on openly available OCSR tools

octopus

A tool for estimating physical and chemical properties of organic molecular compounds

odachi

Advanced deep learning-based organic retrosynthesis engine.

odachi-archive

Advanced deep learning-based organic retrosynthesis engine.

oddt

Open Drug Discovery Toolkit

oddt_test

off-ffcompare

Compare molecular structures after energy minimization in various force fields.

off-target-p-ml

This repository contains the necessary scripts to derive off-target models through (1) A neural network framework based on Keras and Tensorflow (2)An autmomated machine learning framework based on AutoGluon

offlinerl

Experiment for Understanding the Effects of Dataset Characteristics on Offline Reinforcement Learning

offlinerl_modelselection

[MLHC 2021] Model Selection for Offline RL: Practical Considerations for Healthcare Settings. https://arxiv.org/abs/2107.11003

oger

omamer

OMAmer - tree-driven and alignment-free protein assignment to sub-families

omegaconf

Flexible Python configuration system. The last one you will ever need.

omegafold

OmegaFold Release Code

omg

mirror of Open Molecule Generator from https://git.code.sf.net/p/openmg/code

omicannotations

Package to gather gene information, annotations, and functions

omicnavigator

Open-Source Software for Omic Data Analysis and Visualization

omicwas

Cell-Type-Specific Disease Association Testing in Bulk Omics Experiments

ompr

R package to model Mixed Integer Linear Programs

oncortt-method

OncoRTT: Deep learning method to predict novel therapeutic targets in Oncology using BERT embeddings integrated with OMICS features

one_step_retrosynth_ai

This project introduces a novel single-step retrosynthesis approach based on chemical compound substructures and fingerprint descriptors.

onionnet

A multiple-layer inter-molecular contact features based deep neural network for protein-ligand binding affinity prediction

online-chem

Generation of new putative Mdmx inhibitors from scratch based on Recurrent Neural Networks and molecular docking.

ontorxn

Chemical reaction network knowledge graphs: the OntoRXN ontology (copy of https://gitlab.com/dgarayr/ontorxn)

ontorxn_tools

Chemical reaction network knowledge graphs: the OntoRXN ontology (copied from https://gitlab.com/dgarayr/ontorxn_tools.git)

opam

opam is a source-based package manager. It supports multiple simultaneous compiler installations, flexible package constraints, and a Git-friendly development workflow.

open-source-molecular-modelling

open3dalign

mirror of https://svn.code.sf.net/p/open3dalign/open3dalign_svn/trunk

open3dqsar

mirror of https://svn.code.sf.net/p/open3dqsar/open3dqsar_svn/trunk