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Daniel (dwillhelm)

dwillhelm

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Home Page:https://www.linkedin.com/in/danielwillhelm/

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Daniel's starred repositories

label-studio

Label Studio is a multi-type data labeling and annotation tool with standardized output format

Language:JavaScriptLicense:Apache-2.0Stargazers:17542Issues:0Issues:0

moses

Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models

Language:PythonLicense:MITStargazers:802Issues:0Issues:0

faiss_tips

Some useful tips for faiss

Language:ShellLicense:MITStargazers:556Issues:0Issues:0

FinanceToolkit

Transparent and Efficient Financial Analysis

Language:PythonLicense:MITStargazers:2644Issues:0Issues:0

st-annotated-text

A simple component to display annotated text in Streamlit apps.

Language:PythonLicense:Apache-2.0Stargazers:498Issues:0Issues:0

whenever

⏰ Modern datetime library for Python, written in Rust

Language:PythonLicense:MITStargazers:703Issues:0Issues:0

awesome-chemistry-datasets

overview of datasets for ML in chemistry

License:CC0-1.0Stargazers:220Issues:0Issues:0

flowmm

Code for “FlowMM Generating Materials with Riemannian Flow Matching”.

Language:PythonLicense:NOASSERTIONStargazers:49Issues:0Issues:0

moonlighter_bayesian_bandit_pricing

Demonstration of using Baysian bandits method to price items and choose which to sell in a paired-down Moonlighter shop simulation

Language:Jupyter NotebookStargazers:2Issues:0Issues:0

full-stack-fastapi-template

Full stack, modern web application template. Using FastAPI, React, SQLModel, PostgreSQL, Docker, GitHub Actions, automatic HTTPS and more.

Language:TypeScriptLicense:MITStargazers:24738Issues:0Issues:0

exmol

Explainer for black box models that predict molecule properties

Language:Jupyter NotebookLicense:MITStargazers:276Issues:0Issues:0

chemistry_drawer

Draw molecules with plotly!

Language:PythonLicense:BSD-3-ClauseStargazers:33Issues:0Issues:0

chemistry-drawing

A web based tool for chemistry drawings with fabric.js

Language:JavaScriptLicense:MITStargazers:1Issues:0Issues:0

smilesDrawer

A small, highly performant JavaScript component for parsing and drawing SMILES strings. Released under the MIT license.

Language:JavaScriptLicense:MITStargazers:420Issues:0Issues:0

MoINN

Neural Network for Automatic Identification of Chemical Moieties

Language:PythonLicense:MITStargazers:3Issues:0Issues:0

pypyr

pypyr task-runner cli & api for automation pipelines. Automate anything by combining commands, different scripts in different languages & applications into one pipeline process.

Language:PythonLicense:Apache-2.0Stargazers:578Issues:0Issues:0

doit

task management & automation tool

Language:PythonLicense:MITStargazers:1814Issues:0Issues:0

dagobah

Simple DAG-based job scheduler in Python

Language:CSSLicense:WTFPLStargazers:754Issues:0Issues:0

xsmiles

Visualize atom and non-atom attributions and SMILES strings

Language:TypeScriptLicense:BSD-3-ClauseStargazers:41Issues:0Issues:0

MIMOSA

MIMOSA: Multi-constraint Molecule Sampling for Molecule Optimization (AAAI 21')

Language:PythonStargazers:25Issues:0Issues:0

COMA

COMA: Efficient Structure-constrained Molecular Generation using Contractive and Margin losses

Language:Jupyter NotebookLicense:BSD-3-ClauseStargazers:16Issues:0Issues:0

manual-python-geologia

Python para Geólogos

Language:Jupyter NotebookLicense:MITStargazers:164Issues:0Issues:0

cyclopts

Intuitive, easy CLIs based on python type hints.

Language:PythonLicense:Apache-2.0Stargazers:252Issues:0Issues:0

python-fire

Python Fire is a library for automatically generating command line interfaces (CLIs) from absolutely any Python object.

Language:PythonLicense:NOASSERTIONStargazers:26624Issues:0Issues:0

sdk.py

Python optimization SDK

Language:PythonLicense:Apache-2.0Stargazers:8Issues:0Issues:0

chemnlp

ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data

Language:PythonLicense:MITStargazers:64Issues:0Issues:0

atlas

A brain for self-driving laboratories

Language:PythonLicense:MITStargazers:24Issues:0Issues:0

papers-for-molecular-design-using-DL

List of molecular design using Generative AI and Deep Learning

License:GPL-3.0Stargazers:595Issues:0Issues:0

stoned-selfies

This repository contains code for the paper: Beyond Generative Models: Superfast Traversal, Optimization, Novelty, Exploration and Discovery (STONED) Algorithm for Molecules using SELFIES

Language:Jupyter NotebookStargazers:112Issues:0Issues:0

segment-anything-video

MetaSeg: Packaged version of the Segment Anything repository

Language:PythonLicense:Apache-2.0Stargazers:940Issues:0Issues:0