Tag: Molecular dynamics

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Recent Related Articles to Molecular dynamics

ViSNet: A general molecular geometry modeling framework for predicting molecular ... - Microsoft

Added to Collection on: 2024-03-01 08:33:27

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Computational chemistry
Molecular geometry
Molecular modelling
Chemistry
Matter
Molecule
Linear molecular geometry
Force field
Molecular dynamics
Chemical structure

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DeepSP: Deep Learning-Based Spatial Properties to Predict Monoclonal Antibody Stability

Added to Collection on: 2024-03-03 22:55:03

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Immunology
Computational chemistry
Antibody
Glycoproteins
Surrogate model
Molecular dynamics
Viscosity
Machine learning

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Schrödinger Hiring: Apply For a Life Science Education Specialist - BioTecNika

Added to Collection on: 2024-03-28 20:18:01

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Computational chemistry
Drug discovery
Medicinal chemistry
Molecular modelling
Cheminformatics
Erwin Schrödinger
Pharmacophore
Schrödinger, Inc.
Drug design
Docking
Molecular dynamics
Chemical Computing Group
Hyderabad

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Exploring Size, Share, and Trends in the Quantum Computing Drug Discovery Market - WhaTech

Added to Collection on: 2024-04-18 09:10:09

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Quantum information science
Quantum programming
Quantum computing
Theoretical computer science
Classes of computers
Quantum machine learning
Cloud-based quantum computing
Schrödinger, Inc.
Computing
Molecular dynamics
Quantinuum
Draft:OpenQL

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Meta AI Releases Meta's Open Materials 2024 (OMat24) Inorganic Materials Dataset and Models

Added to Collection on: 2024-10-20 20:10:26

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Computational neuroscience
Bioinspiration
Market research
Mathematical psychology
Neural network
Artificial intelligence
Density functional theory
Molecular dynamics

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Rational strategies for improving the efficiency of design and discovery of nanomedicines

Added to Collection on: 2024-11-18 18:48:59

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Drug discovery
Solid lipid nanoparticle
Building block
Combinatorial chemistry
Nanomedicine
Docking
Virtual screening
Nanoparticle
Chemical library
Click chemistry
Molecular dynamics
High-throughput screening

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NNSA Breaks Molecular Dynamics Barrier with Mega Chip | Mirage News

Added to Collection on: 2024-11-20 18:17:00

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Battelle Memorial Institute
Federally Funded Research and Development Centers
United States Department of Energy national laboratories
Cerebras
Parallel computing
Supercomputer
Molecular dynamics
Lawrence Livermore National Laboratory
Simulation
Oak Ridge National Laboratory

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Toward video generative models of the molecular world | MIT News

Added to Collection on: 2025-01-23 17:19:41

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Computational chemistry
Molecular dynamics
Molecular modelling
Simulation
Generative artificial intelligence
MIT Computer Science and Artificial Intelligence Laboratory
Artificial intelligence

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Exploring the structural changes driving protein function with BioEmu-1 - Microsoft Research

Added to Collection on: 2025-02-20 22:16:53

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Protein structure
Protein folding
Molecular dynamics
AlphaFold
Protein
Conformational ensembles
Intrinsically disordered proteins
Protein structure prediction

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A new method to track skyrmions, tiny magnetic whirls formed by atomic magnetism

Added to Collection on: 2025-02-21 08:00:53

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Magnetism
Quasiparticles
Skyrmion
Molecular dynamics
Simulation
Magnetic skyrmion

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