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[HTML][HTML] Molecular visualization on the holodeck
TD Goddard, AA Brilliant, TL Skillman… - Journal of molecular …, 2018 - Elsevier
Can virtual reality be useful for visualizing and analyzing molecular structures and three-
dimensional (3D) microscopy? Uses we are exploring include studies of drug binding to …
dimensional (3D) microscopy? Uses we are exploring include studies of drug binding to …
Exploration of reaction pathways and chemical transformation networks
For the investigation of chemical reaction networks, the identification of all relevant
intermediates and elementary reactions is mandatory. Many algorithmic approaches exist …
intermediates and elementary reactions is mandatory. Many algorithmic approaches exist …
[HTML][HTML] An immersive journey to the molecular structure of SARS-CoV-2: Virtual reality in COVID-19
The era of the explosion of immersive technologies has bumped head-on with the
coronavirus disease 2019 (COVID-19) global pandemic caused by the severe acute …
coronavirus disease 2019 (COVID-19) global pandemic caused by the severe acute …
NAVIG: Augmented reality guidance system for the visually impaired: Combining object localization, GNSS, and spatial audio
Navigating complex routes and finding objects of interest are challenging tasks for the
visually impaired. The project NAVIG (Navigation Assisted by artificial VIsion and GNSS) is …
visually impaired. The project NAVIG (Navigation Assisted by artificial VIsion and GNSS) is …
[HTML][HTML] Interactive molecular dynamics in virtual reality from quantum chemistry to drug binding: An open-source multi-person framework
MB O'Connor, SJ Bennie, HM Deeks… - The Journal of …, 2019 - pubs.aip.org
As molecular scientists have made progress in their ability to engineer nanoscale molecular
structure, we face new challenges in our ability to engineer molecular dynamics (MD) and …
structure, we face new challenges in our ability to engineer molecular dynamics (MD) and …
[HTML][HTML] Exploring human-guided strategies for reaction network exploration: Interactive molecular dynamics in virtual reality as a tool for citizen scientists
RJ Shannon, HM Deeks, E Burfoot, E Clark… - The Journal of …, 2021 - pubs.aip.org
The emerging fields of citizen science and gamification reformulate scientific problems as
games or puzzles to be solved. Through engaging the wider non-scientific community …
games or puzzles to be solved. Through engaging the wider non-scientific community …
Wielding the power of interactive molecular simulations
Since the dawn of the computer age, scientists have designed devices to represent
molecular structures and developed tools to simulate their dynamic behavior in silico. To this …
molecular structures and developed tools to simulate their dynamic behavior in silico. To this …
Ten simple rules to create a serious game, illustrated with examples from structural biology
Serious scientific games are games whose purpose is not just fun. In the field of science, the
serious goals include crucial activities for scientists: outreach, teaching and research. The …
serious goals include crucial activities for scientists: outreach, teaching and research. The …
Interactive flexible-receptor molecular docking in virtual reality using DockIT
Interactive docking enables the user to guide and control the docking of two biomolecules
into a binding pose. It is of particular use when the binding site is known and is thought to be …
into a binding pose. It is of particular use when the binding site is known and is thought to be …
UDock2: interactive real-time multi-body protein–protein docking software
C Plateau-Holleville, S Guionnière, B Boyer… - …, 2023 - academic.oup.com
Motivation Protein–protein docking aims at predicting the geometry of protein interactions to
gain insights into the mechanisms underlying these processes and develop new strategies …
gain insights into the mechanisms underlying these processes and develop new strategies …