chemcomp.com

Chemical Computing Group (CCG) | Computer-Aided Molecular Design

CCG is a leading developer and provider of Molecular Modeling, Simulations and Machine Learning software to Pharmaceutical and Biotechnology companies as well as Academic institutions throughout the world. CCG continuously develops new technologies with its team of mathematicians, scientists and software engineers and through scientific collaborations with customers.


Discovery Platform

  • Common Platform for Chemists
  • Biologists and Crystallographers
  • Small Molecules - Peptides - Biologics
  • Laptop - Cluster - Cloud - Pipeline
  • Integrated Programming Environment

Collaborative Support

  • Expert-Level Scientific Support
  • Scientific Project Collaborations
  • Onsite and Remote Training
  • UGMs, Workshops and Webinars
  • Offices in America, Europe and Asia

Industry Leadership

  • 30+ Years of Innovation
  • Standard Platform in Pharma & Biotech
  • Wide Literature and Patent Citation
  • Worldwide User Community
  • Large-Scale Deployment

Upcoming Events

UGM & Conference 2025
North America

Talks | Posters | Workshops
Montreal, Canada
June 24-25, 2025: Hands-on Workshops
June 26-27, 2025: Scientific Presentations

UGM & Conference 2025
Europe

Talks | Posters | Workshops
Oxford, United Kingdom
May 20-21, 2025: Hands-on Workshops
May 22-23, 2025: Scientific Presentations

MedChem by Design 2025
North America

Talks | Workshops
South San Francisco, CA
May 08, 2025: Hands-on Workshops
May 08, 2025: Scientific Presentations

Latest Releases

MOE 2024.0601

Latest Features

Capture - Document and Share Design Sessions

Pharmacophore-guided High-throughput Biologics Virtual Screening

Map 2D Protein Patch Differences and Ensemble Averages

Updated Amber: EHT Forcefield Parameters from Atom Hybridization Character

Predict ECD and ORD Spectra to Determine Stereochemistry and Conformational Ensembles

Support for Non-natural RNA Bases, Ribose Backbones, and Ionization/Tautomeric States

Interactive Database Viewer Property Filters

Integrated Discovery Platform

  • Small Molecule Peptides Biologics

Multiple Platform Support

  • Windows Mac Linux Cloud

Learn More   Request a Trial

MOEsaic 2024.0601

Latest Features

Identify Chemical Space of Interest with Heatmaps

Predict Activity or Properties with Customized QSAR/QSPR Models

Analyze Multiple Compound Parameters with Radar, Box, and Bar Plots

Web-Based SAR Explorer

  • SAR/SPR Visualization Ligand Analytics MMPs R-Group Profiling

Learn More   Request a Trial

PSILO 2024.06

Latest Features

Create and Maintain Aligned RNA Families

RNA structures Annotated with RFAM Database

Fourier Shell Correlation Plots for CryoEM

Define and Display 3D Biomolecular Assemblies

OKTA Single Sign-on Authentication Support

Protein Structure Database and Visualization System

  • Deposit Organize Browse Search

Learn More   Request a Trial