JChem Microservices
Chemical intelligence built to build on
What is JChem Microservices?
Early-phase drug discovery workflows, chemical inventory management processes and scientific software development demand the use of high-level chemical intelligence. It takes a fortune and decades to research, build and maintain your own solution - but we have done this work for you.
JChem Microservices gives you Chemaxon’s industry-leading chemistry toolkit in a cloud-ready, scalable and modular architecture. It is designed to serve your chemistry related workflows and integrate into your system seamlessly with minimal development effort via simple RESTful APIs.
Enhance chemistry database solutions
Refine your online catalog or store using our toolkit. We provide scalable, robust solutions enhancing chemical search capabilities, improving molecular representation, along with recognition of chemical names and support for various data formats.
Build systems on top-tier chemical intelligence
Level up the science behind your software by building on top-tier chemical intelligence. For example, we provide tools to enumerate chemical entities, calculate and analyze physico-chemical properties, or store and search structural and chemical characteristics of molecules through the JChem Microservices toolkit.
Add chemical functions to existing tools
Augment your existing tools and workflows with best-in-class chemical intelligence. For example, use structure standardization and checking to make sure all your molecules are represented as expected; add physico-chemical properties to support decision making and analysis; or enable connection between different tools using chemical data format conversion.
Reliable property calculations
Before you commit time and resources to making a compound, you want to maximize your chance of success. Accurate chemical property calculations are a given in JChem Microservices. The Calculation Web Services module allows you to access, visualize and store a wide range of calculated properties such as pKa, logD, solubility and more.
Efficient chemical data storage & search
Whether you are managing a laboratory or supplying chemical substances, keeping your database in line is essential. The DB Web Service module in JChem Microservices gives you a way to store and search chemical structures in a persistent database using H2 or PostgreSQL.
Easy integration
When you choose a third party solution, the integration process is always a cardinal question. JChem Microservices is designed to make integration and maintenance easy for you. Its RESTful API is language agnostic, allowing you to build it into your tools using minimal developer time.
JChem Microservices also provides
Format conversions: Seamlessly read, write and convert a wide range of chemical data formats.
Structure handling: Generate, standardize and clean molecular structures in 2D and 3D.
Markush enumeration: Create and enumerate complex Markush structures with ease.
Virtual reaction enumeration: Create virtual libraries from reaction enumeration.
Technology behind JChem Microservices
Reliable service: JChem Microservices maximizes your uptime and thus availability by allowing you to set up multiple instances whether deployed in the cloud or on-premise.
Flexible system: JChem Microservices gives you the freedom to pick and choose the features you need and scale the service to your company's size.
Task management: JChem Microservices manages long-running processes in the background to handle your larger datasets and imports efficiently.
