Author: Stephane Redon

Introduction Nuclear Magnetic Resonance (NMR) spectroscopy is a powerful and versatile analytical tool extensively used in chemistry and biology to determine the structure of molecules, including protein-ligand complexes. Unlike X-ray crystallography that requires crystalline samples, NMR spectroscopy can analyze molecules in solution, closely mimicking physiological conditions. This makes NMR particularly suited for studying interactions between proteins and ligands. This tutorial demonstrates how to use the integration of NMR2, a method developed by Prof. Dr. Julien Orts from Vienna University, into…

More…

This is Part V of What’s new in SAMSON 2023 R1, the release notes for SAMSON 2023 R1. ✅ New Pricing Structure To reflect the major changes introduced in this SAMSON release, we have updated and simplified our pricing structure, and it gives you even more insane value than before! First, the Free Starter Plan lets you do even more than before, with SAMSON AI, Molecular Cycles, Integrated Python Development Environment, and so much more! Second, to make things simpler,…

More…

This is Part IV of What’s new in SAMSON 2023 R1, the release notes for SAMSON 2023 R1. 💡 Interface redesign, and so much more! SAMSON 2023 R1 features a major redesign of the interface to offer a more streamlined experience, with numerous quality-of-life improvements. Context toolbar Now, when selecting nodes in SAMSON, a new context toolbar gives you direct access to the frequently used commands. The toolbar makes it possible to rapidly access SAMSON AI, operate on the selection…

More…

This is Part III of What’s new in SAMSON 2023 R1, the release notes for SAMSON 2023 R1. Integrated Python Development Environment 🐍 The Future of Research and Collaboration with SAMSON Prepare for a radical shift in the way you conduct and share research with SAMSON: the new release goes far beyond the boundaries of typical molecular modeling platforms to bring you a fully integrated Python Development Environment. This is not just an addition; it’s a transformation that empowers you…

More…

This is Part II of What’s new in SAMSON 2023 R1, the release notes for SAMSON 2023 R1. Molecular Cycles 🌟: Studio-Quality Visuals Right Inside SAMSON The SAMSON 2023 R1 release brings another groundbreaking feature that will redefine your visualization experience. We’re proud to announce the integration of the Cycles Renderer from Blender, a renowned, open-source 3D computer graphics software, into SAMSON. Studio-Quality Rendering for Images and Animations For the first time in SAMSON, you can now have stunning, studio-quality…

More…

This is Part I of What’s new in SAMSON 2023 R1, the release notes for SAMSON 2023 R1. SAMSON AI ✨: Your Next-Generation Modeling Assistant We are thrilled to announce one of the most exciting features in SAMSON 2023 R1: SAMSON AI, a cutting-edge assistant powered by an LLM-based architecture integrating the OpenAI API. SAMSON AI isn’t just another chatbot; it’s an intelligent agent designed to make your molecular modeling experience as intuitive, efficient, and rewarding as possible. Here’s how…

More…

SAMSON 2022 R1 brings numerous new features and improvements throughout the core of SAMSON, with a strong focus on user experience! Blazing fast startup First things first, starting SAMSON. As the SAMSON platform is growing and many of you like to customize their environment and add extensions to their installations, we felt it was time to reduce the SAMSON startup time. We are happy to announce that SAMSON now starts an order of magnitude faster, in just a few seconds!…

More…

SAMSON 2021 brings numerous new features and improvements throughout the core of SAMSON, so let’s dive right in!   Introducing the SAMSON Animator One of the most exciting features of this new release of SAMSON is the introduction of the SAMSON Animator, which allows you to create presentations, animations, and movies. The Animator, visible below on the bottom part of the SAMSON interface, is composed of two main parts – the Track view on the left, and the Animation panel…

More…