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Re: Converting COD2020 to SDF [message #1202 is a reply to message #1201]

Fri, 29 January 2021 19:59

nbehrnd
Messages: 233
Registered: June 2019

Senior Member

Coincidental side note: Crystallographic data as basis to set up force fields is a centre of gravity of Hofmann's chapter about small organic molecules in «Data Mining in Crystallography» within the series «Structure and Bonding»:

https://link.springer.com/chapter/10.1007/978-3-642-04759-6_ 4

Norwid

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[Message index]

		Converting COD2020 to SDF By: ghutchis on Thu, 28 January 2021 02:46
		Re: Converting COD2020 to SDF By: thomas on Thu, 28 January 2021 09:58
		Re: Converting COD2020 to SDF By: nbehrnd on Thu, 28 January 2021 15:36
		Re: Converting COD2020 to SDF By: ghutchis on Thu, 28 January 2021 17:00
		Re: Converting COD2020 to SDF By: nbehrnd on Thu, 28 January 2021 22:56
		Re: Converting COD2020 to SDF By: thomas on Fri, 29 January 2021 09:36
		Re: Converting COD2020 to SDF By: nbehrnd on Fri, 29 January 2021 19:59

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