Diffusion MOLEKUEHL b3236b2c31ff

add lots of new reps to try
b3236b2c31ff
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Authored by puckvg on Dec 20 2021, 16:47.

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Description

add lots of new reps to try

Details

Committed

Dec 20 2021, 16:47

Pushed

Dec 20 2021, 16:47

Parents

R11301:500a60d21a77: updated database and search is ok

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puckvg committed R11301:b3236b2c31ff: add lots of new reps to try (authored by puckvg).Dec 20 2021, 16:47

Changes (19)

				Path
	M			GetCM.ipynb
	P			GetFCHL.ipynb Copied from GetSLATM.ipynb
	P			GetFCHLAmons.ipynb Copied from GetSLATMAmons.ipynb
	P			GetSLATM.ipynb Copied to multiple locations: GetFCHL.ipynb GetSOAP.ipynb GetaCM.ipynb
	P			GetSLATMAmons.ipynb Copied to multiple locations: GetFCHLAmons.ipynb GetSOAPAmons.ipynb GetaCMAmons.ipynb
	P			GetSOAP.ipynb Copied from GetSLATM.ipynb
	P			GetSOAPAmons.ipynb Copied from GetSLATMAmons.ipynb
	P			GetaCM.ipynb Copied from GetSLATM.ipynb
	P			GetaCMAmons.ipynb Copied from GetSLATMAmons.ipynb
	M			README.md
	A			amons_FCHL_data.npz
	P			amons_SLATM_data.npz Copied from amons_vector_data.npz
	P			amons_SOAP_data.npz Copied from amons_vector_data.npz
	A			amons_aCM_data.npz
	M			data.npz
	A			target_FCHL_data.npz
	P			target_SLATM_data.npz Copied from target_vector_data.npz
	A			target_SOAP_data.npz
	A			target_aCM_data.npz

R11301:b3236b2c31ff

GetCM.ipynb

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GetFCHL.ipynb

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GetFCHLAmons.ipynb

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GetSLATM.ipynb

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GetSLATMAmons.ipynb

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GetSOAP.ipynb

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GetSOAPAmons.ipynb

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GetaCM.ipynb

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GetaCMAmons.ipynb

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README.md

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amons_FCHL_data.npz

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amons_SLATM_data.npz

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amons_SOAP_data.npz

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amons_aCM_data.npz

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data.npz

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target_FCHL_data.npz

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target_SLATM_data.npz

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target_SOAP_data.npz

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target_aCM_data.npz

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