sirimullalab Goto Github PK
Name: Sirimulla Research Lab
Type: Organization
Location: El Paso, Texas
Name: Sirimulla Research Lab
Type: Organization
Location: El Paso, Texas
Applicability Domain
This automated workflow allows the user to generate a model to predict protein-ligand features through a regression approach. It also offers the user whether he wants to predict a ligand for a specific protein as active or decoy (classification ML approach).
Scaffold Analysis of Ligands Causing GPCR Bias Signaling
BOINC@TACC project: provides a conduit for routing high-throughput computing jobs from TACC resources to the BOINC server.
Cluster-cross-validation for ligand-based models
Repository for COVID19 drug discovery consortium
DLSCORE: A deep learning based scoring function for predicting protein-ligand binding affinity
⏸ Parallelized hyper-param optimization with validation set, not crossval
Model to predict kinase-ligand pKi values.
Workflow that works as a shell where the user inputs protein-ligand data to determine whether a ligand is an active or a decoy for that specific protein
LigandNet, a tool that combines different machine learning models into one platform for protein-specific ligand activity prediction.
Open Drug Metabolism & PharmacoKinetics (OpenDMPK) is an open source data resource and toolkit for predicting drug metabolism and pharmacokinetic properties of drug molecules.
Scripts for finding and analyzing homoplolar C-H···H-C contacts in NMR structures
Lab website
AutoDock VinaXB: implementation of XBSF, new empirical halogen bond scoring function, into AutoDock Vina
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.