Waran GBicecappman.hashnode.dev·Oct 14, 2024The Chemistry of Innovation: Transforming the Future of Energy and OilBy Waran Gajan Bilal Introduction The energy industry stands on the brink of transformation. Balancing the need for sustainable solutions with the demand for fossil fuels has become a complex equation. At the core of this change is chemistry—a discip...Discusschemistry
Chirag Sindhwanichiragsindhwani.hashnode.dev·Oct 8, 2024Getting Started with NequIP: A Comprehensive Guide to Model TrainingThe main reason I'm writing this blog is to save you a week's time dealing with dependencies and issues with their config files, so you can easily install Nequip. You can thank me later. What is NequIP? I doubt you would have come this far if you did...Discuss·11 likes·64 readsAI
Zorayah Jacksonzjackson.hashnode.dev·Sep 2, 2024weekly post ~ aug 26th - sep 1stThis week’s project was still the Chemistry 2048 project. I was super productive and made a lot of progress. Even though I had a busy schedule, I had a ton of energy (probably thanks to my vitamins 💁♀️), but anyways Iet me tell you what got done! F...Discussunity
Zorayah Jacksonzjackson.hashnode.dev·Jun 4, 2024day five ~ june 3rdI took a weekend break, I was sick as a dog and just wanted to SLEEP. But I'm back!! Today was a slow return so I worked on updating the UI for one of my websites (linked here). This one looks especially homemade (time of writing), so I wanted to fix...DiscussGame Development
Eva Hutchchemistryassignmenthelp.hashnode.dev·Jan 16, 2024Fine-Tuning Your Work: Strategies for Handling Modifications in Chemistry TasksEmbarking on a journey through the intricate world of inorganic chemistry assignments can be both challenging and rewarding. As you delve into the depths of chemical equations, reactions, and theories, there may come a point where you find yourself p...Lily Johnson and 6 others are discussing this7 people are discussing thisDiscuss·13 likeseducation
Quantum Cyber Solutionsqcs.hashnode.dev·Nov 20, 2023✨ Growing Crystals: Discover the Magic of Crystal Formation ✨Published on Monday, November 20, 2023 ✨ Growing Crystals: Discover the Magic of Crystal Formation ✨ ================================================================= Authors Name Elon Tusk 😄 Twitter ✨ Growing Crystals: Discover the Magic of Cry...Discusschemistry
Biohacker0corvus-ikshana.hashnode.dev·Sep 21, 2023Introduction to Molecular Docking: Navigating the World of Drug DiscoveryIn this Blog, I will tell you steps and procedures you need to follow to do Molecular Docking. Introduction In the vast landscape of drug discovery, one key question looms large: How do scientists identify molecules that can interact with specific pr...Discuss·43 readsMolecular Docking
Biohacker0corvus-ikshana.hashnode.dev·Sep 21, 2023Molecular Docking : I did itfinally, I was able to do molecular docking of pantoprazole on the proton pump.I have so many things I wanna share that I learned from this experience This article is about what results I got, to know what steps I followed follow this article, it me...Discuss·63 readsMolecular Docking
Biohacker0corvus-ikshana.hashnode.dev·Sep 14, 2023Exploring Stereochemistry with RDKit's EnumerateStereoisomers.pyIn the last blog, we discussed the principle, now we will go through the GitHub code of it. GitHub Link Introduction: I read the whole workings of EnumerateStereoisomers function, what’s the mechanism, and what rules are followed while making these s...Discuss·42 readsbiology
Biohacker0corvus-ikshana.hashnode.dev·Sep 14, 2023Theoretical explanation of RdKit function-`AllChem.EnumerateStereoisomers(input)` for the generation of Stereoisomers.Let's explore how the EnumerateStereoisomers function works at its core. It follows clear principles and a step-by-step mechanism, strictly adhering to specific rules to create valid isomers. I'll break down the process, explain the guiding rules, an...Discuss·52 readsisomers
