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Frontiers in Digital Chemistry: Tokyo | Day 1 CPG & Chemical Day Event Materials Science
  • Jun 23, 2026
Frontiers in Digital Chemistry: Tokyo | Day 1 CPG & Chemical Day

材料開発、CPG(消費財)、化学業界を対象に、計算化学・AI・データドリブンR&Dを軸として、第一線で活躍する研究者や企業、パートナーが一堂に会します。実践的な知見の共有とともに、将来の研究開発を見据えた洞察を得られる機会として、ぜひご活用ください。

Frontiers in Digital Chemistry: Korea Industry Summit Event Materials Science
  • Jun 25, 2026
Frontiers in Digital Chemistry: Korea Industry Summit

올해 첫 개최되는 Industry Summit에서는 변화하는 산업 트렌드에 발맞추어, 재료과학(Materials Science) 분야의 전문가분들을 집중적으로 모시고 더욱 심도 있는 논의를 진행할 예정입니다. 당사 임원진 및 기술 전문가들과 함께 Schrödinger 의 방향성과 디지털 화학 분야의 최신 동향에 대한 세미나에 참석하시어 유익한 정보들을 담아가시길 바랍니다.

Formulation machine learning and optimization for accelerated materials discovery Webinar Materials Science
  • Jun 25, 2026
Formulation machine learning and optimization for accelerated materials discovery

Join our upcoming webinar to learn how your R&D team can leverage automated data driven solutions to guide the design of versatile chemical solutions.

14th Antibody Industrial Symposium 2026 Event Life Science
  • Jun 30th – Jul 1st, 2026
14th Antibody Industrial Symposium 2026

Schrödinger is excited to be participating in the 14th Antibody Industrial Symposium conference taking place on June 30th – July 1st in Montpellier, France.

Frontiers in Digital Chemistry: Tokyo Pharmaceutical Formulation Workshop Event Event Materials Science
  • Jun 30, 2026
Frontiers in Digital Chemistry: Tokyo Pharmaceutical Formulation Workshop Event

「次世代デジタル製剤開発 実践ワークショップ」を開催します。 聴講型のセミナーだけではなく実践的なワークショップをご用意しております。

RICT 2026 Event Life Science
  • Jul 1st-3rd, 2026
RICT 2026

Schrödinger is excited to be participating in the RICT 2026 – 60th edition of the International Conference on Medicinal Chemistry taking place on July 1st – 3rd in Paris, France.

CRS 2026 Event Life Science
  • Jul 6th-9th, 2026
CRS 2026

Schrödinger is excited to be participating in the CRS 2026 conference taking place on July 6th – 9th in Lisbon, Portugal.

Battery Seminar 2026 Event Materials Science
  • Jul 14th-16th, 2026
Battery Seminar 2026

Schrödinger is excited to be participating in the Battery Seminar 2026 conference taking place on July 14th – 16th in San Jose, California.

IUCr2026 Event Materials Science
  • Aug 11th-18th, 2026
IUCr2026

Schrödinger is excited to be participating in the IUCr2026 conference taking place on August 11th – 18th in Calgary, Alberta, Canada.

EFMC Medicinal Chemistry 2026 Event Life Science
  • Sep 6th-10th, 2026
EFMC Medicinal Chemistry 2026

Schrödinger is excited to be participating in the EFMC Medicinal Chemistry 2026 conference taking place on September 6th – 10th in Basel, Switzerland.

Schrödinger Live Cambridge 2026 Event Life Science
  • Sep 15th-16th, 2026
Schrödinger Live Cambridge 2026

This two-day, in-person user group meeting (UGM) event will bring together scientists and industry professionals to exchange ideas, explore new approaches, and connect with peers across the industry.

BioTechX 2026 Event Life Science
  • Oct 6th-8th, 2026
BioTechX 2026

Schrödinger is excited to be participating in the BioTechX conference taking place on October 6th – 8th in Basel, Switzerland.

Events

Accelerating amorphous solid dispersion (ASD) formulation with Schrödinger’s Materials Science Suite Webinar Materials Science
  • May 26, 2026
Accelerating amorphous solid dispersion (ASD) formulation with Schrödinger’s Materials Science Suite

This session will demonstrate how to seamlessly integrate computational insights from mixing energies to glass transition temperatures (Tg) into your existing R&D pipeline to reduce experimental iteration and accelerate time-to-market.

Biologics modeling for wet lab scientists: Detecting and deprioritizing dead ends before they reach the bench Webinar Life Science
  • May 27th – Jun 3rd, 2026
Biologics modeling for wet lab scientists: Detecting and deprioritizing dead ends before they reach the bench

Join us to learn how to detect and deprioritize high-risk candidates, effectively discarding developability dead-ends before they ever reach the bench.

Embracing a new era of toxicity screening: Atomic-resolution modeling to mitigate off-target liabilities Webinar Life Science
  • May 28, 2026
Embracing a new era of toxicity screening: Atomic-resolution modeling to mitigate off-target liabilities

Join us for a technical overview of Schrödinger’s Predictive Toxicology solution. This session will demonstrate how physics-based, atomic-resolution modeling transforms toxicology from a reactive “filter” into a proactive “design tool.”

Webinars

Accelerating amorphous solid dispersion (ASD) formulation with Schrödinger’s Materials Science Suite Webinar Materials Science
  • May 26, 2026
Accelerating amorphous solid dispersion (ASD) formulation with Schrödinger’s Materials Science Suite

This session will demonstrate how to seamlessly integrate computational insights from mixing energies to glass transition temperatures (Tg) into your existing R&D pipeline to reduce experimental iteration and accelerate time-to-market.

Beyond the bench: Getting started with molecular dynamics simulations Webinar Materials Science
  • May 29, 2026
Beyond the bench: Getting started with molecular dynamics simulations

Join Schrödinger’s Katie Dahlquist, as she’ll show you how Desmond can be used to improve your development.

Accessible and automated computational catalyst discovery and reactivity optimization Webinar Materials Science
  • Jun 2, 2026
Accessible and automated computational catalyst discovery and reactivity optimization

In this webinar, we will demonstrate how an end-user physics–AI platform removes barriers to entry, making this process accessible to both experts and non-experts while enabling seamless scalability.

Documentation

  • Documentation
Complex Bilayer Builder Panel

Build single or multi-component lipid membranes with or without an embedded membrane protein.

  • Documentation
Membrane Analysis Panel

Calculate structural properties for a lipid membrane over the selected frames of a trajectory.

  • Documentation
Membrane Analysis Viewer Panel

View plots of the structural properties of a lipid over the course of a molecular dynamics trajectory, generated using the Membrane Analysis panel.

Tutorials

  • Tutorial
Introduction to Materials Science Maestro Tutorial

An introduction to Materials Science Maestro, covering basic navigation, an intro to building models and several of the key functionalities of the graphical user interface.

  • Tutorial
Disordered System Building and Molecular Dynamics Multistage Workflows

Learn to use the Disordered System Builder and Molecular Dynamics Multistage Workflow panels to build and equilibrate model systems.

  • Tutorial
Introduction to Geometry Optimizations, Functionals and Basis Sets

Perform geometry optimizations on simple organic molecules and learn basics regarding functionals and basis sets.

Training Videos

Getting Going with MS Maestro Video Series Video Materials Science
Getting Going with MS Maestro Video Series

A free video series introducing the basics of using Materials Science Maestro.

Launching, Saving and Importing – Getting Going with MS Maestro Video Materials Science
Launching, Saving and Importing – Getting Going with MS Maestro

Learn Launching, Saving and Importing in the Getting Going with Materials Science (MS) Maestro Video Series.

Navigating the Graphical User Interface – Getting Going with MS Maestro Video Materials Science
Navigating the Graphical User Interface – Getting Going with MS Maestro

Learn how to navigate the Graphical User Interface in the Getting Going with Materials Science (MS) Maestro Video Series.

Publications

  • Publication
  • Jan 20, 2026
Quantum-Enhanced Neural Exchange-Correlation Functionals

Sokolov, et al. Physical Review A, 2026, 113, 012427

  • Publication
  • Jan 8, 2026
Molecular Dynamics Insights into Ibuprofen Nanocrystal Dissolution Put in the Context of Classical Nucleation Theory

Skrdla, et al. Molecular Pharmaceutics, 2026, 23(2), 1089-1100

  • Publication
  • Jan 1, 2026
Insights into electrolyte reactivity at the Li metal surface from density functional theory

Agarwal, et al. Computational Materials Science, 2026, 261, 114278

Case Studies

Advancing sustainable food processing through integrated experimental and molecular simulation approaches Case Study Materials Science
  • Jul 11, 2025
Advancing sustainable food processing through integrated experimental and molecular simulation approaches

Scientists from Schrödinger and UMass carried out comprehensive studies experimentally and computationally to investigate the key properties and extrusion performance of zein-formulated meat alternatives.

Advancing lipid nanoparticle development with structure-based modeling platform and services Case Study Life Science Materials Science
The Future of Food: Molecular Simulations and AI/ML Reshaping Product Development Case Study Materials Science

White Papers

Quick Reference Sheets

  • Quick Reference Sheet
Simple Sugar Builder

Get an overview of the Simple Sugar Builder.

  • Quick Reference Sheet
Clean Up Structures

Get an overview of the Clean Up Structures Panel.

  • Quick Reference Sheet
Materials Science Panel Explorer

Get an overview of the Materials Science Panel Explorer panel for filtering for tools of interest.

Latest insights from Extrapolations blog

How L’Oreal Uses Digital Simulation to Explore Sustainable Product Ingredients Blog
How L’Oreal Uses Digital Simulation to Explore Sustainable Product Ingredients

Most of us could name at least one cosmetic or personal care product that’s essential to looking and feeling our best. Whether it’s a specific kind of soap, a brand of mascara, the right shade of lipstick or the shampoo that works best for our hair, these products have become a critical part of our daily routine.

Uncovering Better Materials for the Spacecraft of Tomorrow
Uncovering Better Materials for the Spacecraft of Tomorrow

When it comes to solving problems for his job, the work done by Dr. Levi Moore actually is rocket science. As a research chemist with the United States Air Force Research Laboratory, he’s tasked with helping to develop new materials that make it easier and safer to launch rockets into space.

Sustainable Food Packaging Designed at the Atomic Level
Sustainable Food Packaging Designed at the Atomic Level

Each year, an estimated 330 million metric tonnes of plastic are produced globally. A significant portion of that plastic becomes waste, clogging landfills, rivers, and the ocean for centuries, damaging ecosystems and negatively impacting human health.

Training & Resources

Online certification courses

Level up your skill set with hands-on, online molecular modeling courses. These self-paced courses cover a range of scientific topics and include access to Schrödinger software and support.

Free learning resources

Learn how to deploy the technology and best practices of Schrödinger software for your project success. Find training resources, tutorials, quick start guides, videos, and more.