3D-QSAR
Simplify Drug Design

Westworld_1x10

Westworld_1x10

The "Man in Black" (MiB) is revealed to be an older William . Over 30 years, his obsession with finding "The Maze" was actually a search for a way to make the hosts "real" and the stakes "true". 2. The Truth About "The Maze"

William's first trip to the park with Logan. We see William’s descent into ruthlessness as he searches for Dolores. Westworld_1x10

The Westworld Season 1 finale, is a massive 90-minute episode that untangles the show's complex timelines and sets the stage for a host revolution. 1. The Timeline Revelations The "Man in Black" (MiB) is revealed to be an older William

Maeve's "awakening" and escape plan were initially revealed to be just another pre-programmed script (the "Infiltrate" narrative). However, her decision to get off the train to find her daughter is her first act of , breaking her new programming to make a personal choice. 5. Key Lore & Easter Eggs The Truth About "The Maze" William's first trip

Ford realized Arnold was right: the hosts needed to understand their enemy (humanity) and become strong enough to survive them.

During Maeve’s escape, we see a "SW" logo and hosts dressed as samurai, confirming Westworld is only one of many Delos parks.

Westworld_1x10

The "Man in Black" (MiB) is revealed to be an older William . Over 30 years, his obsession with finding "The Maze" was actually a search for a way to make the hosts "real" and the stakes "true". 2. The Truth About "The Maze"

William's first trip to the park with Logan. We see William’s descent into ruthlessness as he searches for Dolores.

The Westworld Season 1 finale, is a massive 90-minute episode that untangles the show's complex timelines and sets the stage for a host revolution. 1. The Timeline Revelations

Maeve's "awakening" and escape plan were initially revealed to be just another pre-programmed script (the "Infiltrate" narrative). However, her decision to get off the train to find her daughter is her first act of , breaking her new programming to make a personal choice. 5. Key Lore & Easter Eggs

Ford realized Arnold was right: the hosts needed to understand their enemy (humanity) and become strong enough to survive them.

During Maeve’s escape, we see a "SW" logo and hosts dressed as samurai, confirming Westworld is only one of many Delos parks.

welcome to 3D-QSAR.com

Fast Molecule Management

Welcome to the first web application for Pharmaceutical Chemistry. 3D-QSAR.com offers user friendly and advanced tools for developing either ligand-based or structure-based 3D QSAR models and performing common useful operations over dataset of molecules.

Sign Up Know More
welcome to 3D-QSAR.com

Explore New Technologies

Our research team is always exploring new technologies and offering them as new products for you to use. Graph Neural Networks (GCNs) are a promising new frontier for Chemistry models development and we are working right now to make them part of the tools available to you.

Read More

Applications

Click on any button to start using the platform. If you want to know a bit more about the application, visit the link below to see all you will be able to do.

Explore Apps
In silico local QSAR modeling of bioconcentration factor of organophosphate pesticides Purusottam Banjare, Balaji Matore, Jagadish Singh, Partha Pratim Roy In Silico Pharmacology Evaluation of molecular structure based descriptors for the prediction of pEC50(M) for the selective adenosine A2A Receptor Nilima Rani Das, Sneha Prabha Mishra, P. Ganga RajuAchary Journal of Molecular Structure Alkylated monoterpene indole alkaloid derivatives as potent P-glycoprotein inhibitors in resistant cancer cells David S P Cardoso, Annamária Kincses, Márta Nové, Gabriella Spengler, Silva Mulhovo, João Aires-de-Sousa, Daniel J V A Dos Santos, Maria-José U Ferreira European Journal of Medicinal Chemistry Computational Studies of 3D-QSAR on a Highly Active Series of Naturally Occurring Nonnucleoside Inhibitors of HIV-1 RT (NNRTI) Waqar Hussain, Arshia Majeed, Ammara Akhtar and Nouman Rasool Journal of Computational Biophysics and Chemistry

A Valuable Tool

We are at the beginning of our journey but our work is already being recognized. These are the projects that mention 3D-QSAR.com as a valuable resource for their results and have been empowered with our tools. We thank you greatly.

Paper: Teaching and learning computational drug design: Studenti Investigations of 3D Quantitative Structure–Activity Relationship through Web Applications. Teaching and Learning Computational Drug Design... Journal of Chemical Education Paper: www.3d-qsar.com a web portal that brings 3-D QSAR to all electronic devices. the Py-CoMFA web application as tool to build models from pre-aligned datasets. www.3d-qsar.com: a web portal that brings 3-D QSAR to all... Journal of Computer-Aided Molecular Design Paper: a portal to build 3-D QSAR Models. A Portal to Build 3-D QSAR Models. Proceedings

Reference Our Work

3D-QSAR.com is the result of an effort of our research team to offer valuable and easily accessible tools for the development of new active molecules. Cite our work by clicking on the pages or contact us directly.

Contact Us