Cresset, a provider of software and services for small molecule discovery and design, has announced the release of Forge V10.4, the latest version of its computational chemistry workbench for ligand-based design
Genedata has introduced version 4.0 of Genedata Selector, a genome knowledge management solution with capabilities for reference-independent genome sequence comparisons while reducing data processing and analysis time
Cresset has released version 10.4 of Torch, a 3D molecule design tool for medicinal and synthetic chemists
Accelrys has announced the availability of an extensive set of advanced predictive sciences applications and services
Dotmatics has released a new chemical drawing software designed to increase the productivity of chemists in the industry and in academia
Cresset has announced that Activity Miner, a new intuitive SAR interpretation tool that identifies the key 3D structural and electrostatic changes impacting biological activity, is available as a module in its Torch and Forge software suites.
Simulations Plus, a provider of simulation and modelling software for pharmaceutical discovery and development, has released version 8.5 of its GastroPlus software for the simulation of gastrointestinal absorption, pharmacokinetics, and pharmacodynamics
Certara, a provider of software and scientific consulting services to improve productivity and decision-making from drug discovery through drug development, has released version 13 of its Simcyp Simulator
Certara has released version 2.1 of its SYBYL-X molecular modelling and simulation suite
Cresset has released a new Activity Miner module. The company says the product helps researchers optimise their leads by identifying the key 3D structural and electrostatic changes that impact molecular activity
Things are hotting up in the world of weather and climate forecasting thanks to today’s highly ambitious projects
Drug discovery is a complex process that requires increasing resources and time to generate new molecules. As the processes have matured there is an increasing reliance on computational methods to accelerate the discovery process.
Patients across the UK will benefit from better healthcare, treatments and faster diagnosis as the government sets out plans to deliver genomic healthcare
One of the most obvious, and immediate challenges when bringing new software into a lab environment is the likely ‘spaghetti soup’ of existing platforms – possibly from multiple vendors – that are already installed, suggests Richard Milne
With the growth of AI and DL comes new opportunities for emerging applications finds Robert Roe
Robert Roe takes a look at the training and skills development opportunities for scientists using HPC in their research
A round-up of the latest cooling technologies for scientists using HPC to support their research
A round-up of the latest storage products and technology available for scientists using HPC as a tool for their research
