Skip to content
View LanceKnight's full-sized avatar
😎
😎
27 followers · 23 following

Achievements

Achievement: StarstruckAchievement: QuickdrawAchievement: Pull Sharkx2

Achievements

Achievement: StarstruckAchievement: QuickdrawAchievement: Pull Sharkx2

Block or report LanceKnight

Block user

Prevent this user from interacting with your repositories and sending you notifications. Learn more about blocking users.

You must be logged in to block users.

Please don't include any personal information such as legal names or email addresses. Maximum 100 characters, markdown supported. This note will be visible to only you.
Report abuse

Contact GitHub support about this user’s behavior. Learn more about reporting abuse.

Report abuse

  • gnn-descriptor Public

    Python 2 1 Updated Jul 11, 2024

  • WelQrate Public

    WelQrate: Defining the Gold Standard in Small Molecule Drug Discovery Benchmarking

    Jupyter Notebook 1 Updated Jun 26, 2024

  • MolKGNN Public

    MolKGNN is a deep learning model for predicting biological activity or molecular properties. It features in 1. SE(3)-invariance 2. conformation-invariance 3. interpretability. MolKGNN uses a novel …

    deep-learning drug-discovery graph-neural-networks
    Python 11 5 Updated Jan 22, 2024

  • TDC Public

    Forked from mims-harvard/TDC

    Therapeutics Data Commons: Machine Learning Datasets and Tasks for Drug Discovery and Development

    Jupyter Notebook MIT License Updated Jan 16, 2023

  • BCL-GUI Public

    A html-based app for an interactive GUI interface for BCL using ketcher as editor and JSMol as viewer. Electron framework was used for desktop application. The project is under NodeJS framework. Fr…

    JavaScript Updated Dec 10, 2022

  • ogb-lsc-pcqm4mv2 Public

    Forked from graphcore/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

    Jupyter Notebook MIT License Updated Nov 23, 2022

  • Graphormer Public

    Forked from microsoft/Graphormer

    This is the official implementation for "Do Transformers Really Perform Bad for Graph Representation?".

    Python 1 MIT License Updated Jan 20, 2022

  • pretrain-gnns Public

    Forked from snap-stanford/pretrain-gnns

    Strategies for Pre-training Graph Neural Networks

    Jupyter Notebook 1 MIT License Updated Nov 12, 2021

  • Library-Management-System Public

    Project for UTD CS6360 Database Design. Developed a SQL based databased and has a java GUI interface

    Java Updated Oct 9, 2021

  • MoCL-DK Public

    Forked from illidanlab/MoCL-DK

    Implementation for the paper MoCL: Contrastive Learning on Molecular Graph with multi-level Domain Knowledge

    Python Updated Aug 30, 2021

  • UFO-Reports-Data-Visualization Public

    Forked from xuezzou/Exploring-UFO-Sighting

    Final Project of 5891 Data Visualization, Fall 2018 Vanderbilt. Visualization of UFO reports, which is geographical data. Features including zooming/panning/subplot and etc.

    JavaScript Updated Aug 23, 2021

  • PropertyPredictor Public

    Python Updated Jul 24, 2021

  • Hit_Explosion Public

    Jupyter Notebook Updated Jul 10, 2021

  • Meta-MGNN Public

    Forked from zhichunguo/Meta-MGNN

    Few-Shot Graph Learning for Molecular Property Prediction

    Python 1 Updated Apr 20, 2021

  • conv_qsar_fast Public

    Forked from connorcoley/conv_qsar_fast
    Python MIT License Updated Feb 23, 2021

  • geo-gcn Public

    Forked from gmum/geo-gcn

    The official implementation of the SGCN architecture.

    Python MIT License Updated Dec 22, 2020

  • SynthesizabilityPredictor Public

    Jupyter Notebook Updated Nov 9, 2020

  • Protein-flexibility Public

    Project of CS 8395 Open Source Programming for Medical Image Processing, Fall 2018 Vanderbilt. A program based on VTK library to show the distance of two conformations of a protein. The further the…

    C++ 1 Updated Nov 3, 2020

  • graph-neural-networks-for-drug-discovery Public

    Forked from edvardlindelof/graph-neural-networks-for-drug-discovery
    Python 1 1 MIT License Updated Apr 28, 2020

  • GGM Public

    Forked from jaechanglim/GGM

    graph generative model for molecule

    Python Updated Dec 17, 2019

  • CHEM5420 Public

    Archive of Homeworks for CHEM 5420 Computational Structural Biology

    MATLAB Updated Sep 20, 2019

  • drug-toxicity-interface Public

    Updated Sep 19, 2019

  • Ray-Tracing Public

    Project of CS 5258 Computer Graphics, Spring 2019 Vanderbilt. It has a Command Line Interface(CLI) that can interpret and execute predefined commands. The program can read and write TIFF image. Res…

    C Updated May 7, 2019

  • EdX-Computer-Graphics Public

    Project of EdX Computer Graphics. Translation, Rotation

    C++ Updated Mar 6, 2019

  • Data-Visualization Public

    Project of Vandy CS-5891-06 Intro to Visualization. Various tasks included. Written in javascript using d3.

    JavaScript 1 Updated Oct 25, 2018

  • Decision-Tree Public

    A decision tree prototype

    Python Updated Oct 8, 2018

  • GithubTest Public

    Test of different functions of Github

    Updated Oct 2, 2018

  • BoostTest Public

    Test of Boost library in C++

    Makefile Updated Oct 2, 2018

  • Wink-Detection Public

    Project of UTD CS6384 Computer Vision. Detect wink

    C++ Updated Sep 22, 2018

  • Theater-Ticket-System Public

    Project of UTD CS4348 Operating System. A program to simulate box office for buying tickets.

    Java Updated Sep 22, 2018