Search for tag: "vlab-workshop"
OpenMKM Inputs and Examples of pMuTT and pGrAddPart 2 of the talk given by Dr. Gerhard Wittreich at the Virtual Kinetics Lab (VLab) Online Workshop on 13th December 2023. Workshop Details: https://dei.udel.edu/vlab_workshop/
From Siddhant Meenor Lambor
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Fundamentals of MicrokineticsPart 1 of the talk given by Prof. Dionisios Vlachos (Unidel Dan Rich Chair in Energy Professor; Director – DEI, CCEI) at the Virtual Kinetics Lab (VLab) Online Workshop on 11th December…
From Siddhant Meenor Lambor
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Automation in Microkinetic ModelingPart 2 of the talk given by Prof. Dionisios Vlachos (Unidel Dan Rich Chair in Energy Professor; Director – DEI, CCEI) at the Virtual Kinetics Lab (VLab) Online Workshop on 11th December…
From Siddhant Meenor Lambor
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Reaction Mechanisms and Statistical ThermodynamicsPart 1 of the talk given by Dr. Gerhard Wittreich at the Virtual Kinetics Lab (VLab) Online Workshop on 12th December 2023. Workshop Details: https://dei.udel.edu/vlab_workshop/
From Siddhant Meenor Lambor
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pMuTT - python Multiscale Modeling ToolkitPart 2 of the talk given by Dr. Gerhard Wittreich at the Virtual Kinetics Lab (VLab) Online Workshop on 12th December 2023. Workshop Details: https://dei.udel.edu/vlab_workshop/
From Siddhant Meenor Lambor
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Semi-empirical methods and pGrAdd - python Group AdditivityPart 1 of the talk given by Dr. Gerhard Wittreich at the Virtual Kinetics Lab (VLab) Online Workshop on 13th December 2023. Workshop Details: https://dei.udel.edu/vlab_workshop/
From Siddhant Meenor Lambor
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OpenMKM - Open Source Microkinetic ModelingTalk given by Dr. Sashank Kasiraju (Computational Scientist, University of Delaware) at the Virtual Kinetics Lab (VLab) Online Workshop on 14th December 2023. Workshop Details:…
From Siddhant Meenor Lambor
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ReNView - Reaction Network ViewerTalk given by Dr. Udit Gupta (Solutions Architect, Siemens) at the Virtual Kinetics Lab (VLab) Online Workshop on 14th December 2023. Workshop Details: https://dei.udel.edu/vlab_workshop/
From Siddhant Meenor Lambor
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petBOA - Parameter Estimation with Bayesian OptimizationTalk given by Dr. Sashank Kasiraju (Computational Scientist, University of Delaware) at the Virtual Kinetics Lab (VLab) Online Workshop on 14th December 2023. Workshop Details:…
From Siddhant Meenor Lambor
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CKineticsDB - Chemical Kinetics DatabaseTalk given by Siddhant Lambor (Computer Software Engineer, University of Delaware) at the Virtual Kinetics Lab (VLab) Online Workshop on 15th December 2023. Workshop Details:…
From Siddhant Meenor Lambor
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NEXTorch - Next Experiment toolkit in PyTorch/BoTorchTalk given by Dr. Yifan Wang (Research Scientist, Meta) at the Virtual Kinetics Lab (VLab) Online Workshop on 15th December 2023. Workshop Details: https://dei.udel.edu/vlab_workshop/
From Siddhant Meenor Lambor
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AIMSIM - Artificial Intelligence Molecular Similarity; and astartesTalk given by Jackson Burns (DOE Fellow; PhD candidate, MIT) at the Virtual Kinetics Lab (VLab) Online Workshop on 15th December 2023. Workshop Details: https://dei.udel.edu/vlab_workshop/
From Siddhant Meenor Lambor
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