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How To Frontside Snap ¦ The ULTIMATE Tutorial (POV + Skate Simulation)

Here's the ULTIMATE GUIDE to the Frontside Snap! In this video, I break down every step to the FS Snap – using POV, Drone & Land footage to show ALL angles + a SKATE SIMULATION to practice out of the ...
IEEE

Two Birds With One Stone: Targeting Wild Type and Drug Resistant Mutant ALK Using Brute Force Screening, MD Simulation and NCI

Abstract: Anaplastic lymphoma kinase (ALK) belongs to the class of receptor tyrosine kinase (RTK) subfamily of enzymes which plays a crucial role in cell proliferation, and differentiation, however ...
Frontiers

Pharmacophore screening, molecular docking, and MD simulations for identification of VEGFR-2 and c-Met potential dual inhibitors

Introduction: The vascular endothelial growth factor receptor 2 (VEGFR-2) and the mesenchymal-epithelial transition factor (c-Met) are critical in the pathogenesis and progression of various cancers ...
Cancer Research

Abstract B109: Drug repurposing for T315I mutation in CML through virtual screening and md simulation

Currently, many health incidentals are allocated to diagnosing and treating cancer. Even with the significant advancements in cancer research, there are still many challenges in treating the drug ...
GitHub

Issue Running Ariane Co-Simulation Tutorial: Bootram File Loading Problem

I hope this isn't too much of a beginner's question, but I ran into a problem while following the Ariane co-simulation tutorial. I rolled all the repositories back to the December 2019 versions, when ...
marktechpost

MIT Researchers Introduce Generative Modeling of Molecular Dynamics: A Multi-Task AI Framework for Accelerating Molecular Simulations and Design

Molecular dynamics (MD) is a popular method for studying molecular systems and microscopic processes at the atomic level. However, MD simulations can be quite computationally expensive due to the ...
C&EN

Introductory Tutorials for Simulating Protein Dynamics with GROMACS

Creative Commons (CC): This is a Creative Commons license. Attribution (BY): Credit must be given to the creator. Atomistic molecular dynamics (MD) simulations have become an indispensable tool for ...