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import streamlit as st |
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st.title("🩺🔍 Search Results") |
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st.markdown("**Date:** 08 Dec 2023") |
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st.markdown("**Title:** Machine-learned molecular mechanics force field for the simulation of protein-ligand systems and beyond") |
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st.markdown("[**Abstract Link**](https://arxiv.org/abs/2307.07085)") |
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st.markdown("[**PDF Link**](https://arxiv.org/pdf/2307.07085)") |
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st.write("---") |
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search_data = [ |
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{"Date": "08 Dec 2023", "Title": "Machine-learned molecular mechanics force field for the simulation of protein-ligand systems and beyond", "Abstract Link": "https://arxiv.org/abs/2307.07085", "PDF Link": "https://arxiv.org/pdf/2307.07085"}, |
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{"Date": "11 Apr 2023", "Title": "Design, Integration, and Field Evaluation of a Robotic Blossom Thinning System for Tree Fruit Crops", "Abstract Link": "https://arxiv.org/abs/2304.04919", "PDF Link": "https://arxiv.org/pdf/2304.04919"}, |
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] |
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st.write("### 📅 Summary of Search Results") |
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st.table(search_data) |
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st.markdown(''' |
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Discovery of Espaloma-0.3 (Hero's Journey) |
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Ordinary World: Traditional force fields struggle with flexibility and extensibility. |
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Call to Adventure: Researchers propose a new approach using graph neural networks. |
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Refusal of the Call: Skeptics doubt the new method's feasibility without extensive computational resources. |
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Meeting the Mentor: Collaboration with experts in quantum chemistry and machine learning. |
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Crossing the Threshold: Initial tests show promising results, validating the concept. |
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Tests, Allies, and Enemies: The method faces challenges with specific molecular systems but gains support. |
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Approach to the Inmost Cave: Intensive training on a diverse dataset. |
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Ordeal: Tackling edge cases and ensuring stability in simulations. |
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Reward: The model achieves impressive accuracy and robustness. |
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The Road Back: Publication and refinement for real-world applications. |
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Resurrection: Acceptance and adoption in the wider scientific community. |
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Return with the Elixir: A new, powerful tool for drug discovery and molecular simulations. |
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Robotic Blossom Thinning (Rags to Riches) |
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Initial Wholeness: Apple orchards rely heavily on manual labor. |
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Fall from Grace: Inefficiency and cost concerns rise. |
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Journey: Researchers develop a robotic solution for blossom thinning. |
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Personal Resolve: Field tests reveal the robot's potential. |
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Self-discovery: Optimizing the end-effector's performance. |
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Major Victory: Significant reduction in labor and cost. |
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False Defeat: Encountering technical issues during deployment. |
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Final Victory: Successful large-scale adoption of the robotic system. |
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Climax: Recognition of the system’s effectiveness and efficiency. |
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Happily Ever After: Sustainable and cost-effective orchard management. |
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Graph-Neural-Network Approach for Force Fields (Quest) |
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Goals: Develop accurate and extendible force fields for large organic molecules. |
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Challenges: Accurately modeling complex interactions. |
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Journey: Combining physics-driven potentials with neural network models. |
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Teamwork: Collaboration between physicists, chemists, and data scientists. |
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Trials: Extensive testing on different molecular sizes. |
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Transformation: The approach proves to be robust and extendible. |
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Setbacks: Refining the model for diverse chemical domains. |
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Redemption: Improved predictions for new molecular systems. |
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Success: Establishing a new standard for force field development. |
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Homecoming: Adoption in scientific research and industry applications. |
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''') |
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import streamlit as st |
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st.title("🩺🔍 Search Results") |
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st.header("Discovery of Espaloma-0.3 (Hero's Journey) 🧙♂️") |
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st.markdown("1. **Ordinary World:** Traditional force fields struggle with flexibility and extensibility.") |
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st.markdown("2. **Call to Adventure:** Researchers propose a new approach using graph neural networks.") |
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st.header("Robotic Blossom Thinning (Rags to Riches) 🛠️") |
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st.markdown("1. **Initial Wholeness:** Apple orchards rely heavily on manual labor.") |
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st.header("Graph-Neural-Network Approach for Force Fields (Quest) 🕵️♂️") |
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st.markdown("1. **Goals:** Develop accurate and extendible force fields for large organic molecules.") |
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st.write("### 📅 Summary of Search Results") |
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search_data = [ |
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{"Date": "08 Dec 2023", "Title": "Machine-learned molecular mechanics force field for the simulation of protein-ligand systems and beyond", "Abstract Link": "https://arxiv.org/abs/2307.07085", "PDF Link": "https://arxiv.org/pdf/2307.07085"}, |
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{"Date": "11 Apr 2023", "Title": "Design, Integration, and Field Evaluation of a Robotic Blossom Thinning System for Tree Fruit Crops", "Abstract Link": "https |
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