Vault Snack #6: CDD Vault users may now sort and filter their ELN Index page, as well as customize which columns to display.
Vault Snack #6 – The Best Menu Around! Vault Snack #6: CDD Vault users may now sort and filter their ELN Index page, as well as customize which columns to display. The post Vault Snack #6 – The Best Menu Around! appeared first on Collaborative Drug Discovery Inc. (CDD). by Abe Wang, CDD
Webpage: https://ift.tt/2QPdPn5
Bengaluru: November 26, 2019 at 12:37AM

TURBOMOLE is a powerful Quantum Chemistry (QC) program package and one of the fastest and most stable codes available for standard quantum chemical applications (HF, DFT, MP2). Unlike many other programs, the main focus in the development of TURBOMOLE has not been to implement all new methods and fu...
Turbomole 7.4.1 released Dear Turbomole Users, Turbomole version 7.4.1 has been released, this is a bugfix version for 7.4 and mainly resolves technical issues with Intel MPI. Initially it was assumed that there is a bug in riper when using ECPs, but this turned out to be not ... Source: Turbomole Forum
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Bengaluru: November 25, 2019 at 02:23PM

CDD Webinar: Capturing Mixtures — Bringing Informatics to the World of Practical Chemistry — Dec 19, 2019
Upcoming CDD Webinar: Capturing Mixtures — Bringing Informatics to the World of Practical Chemistry CDD Webinar: Capturing Mixtures — Bringing Informatics to the World of Practical Chemistry — Dec 19, 2019 The post Upcoming CDD Webinar: Capturing Mixtures — Bringing Informatics to the World of Practical Chemistry appeared first on Collaborative Drug Discovery Inc. (CDD). by Abe Wang, CDD
Webpage: https://ift.tt/2OfzPV9
Bengaluru: November 15, 2019 at 01:18PM

CDD is presenting at the Proventa Medicinal Chemistry Strategy Meeting in Boston, MA on November 14, 2019.
CDD Presenting at Proventa Medicinal Chemistry Strategy Meeting, Boston on November 14, 2019 CDD is presenting at the Proventa Medicinal Chemistry Strategy Meeting in Boston, MA on November 14, 2019. The post CDD Presenting at Proventa Medicinal Chemistry Strategy Meeting, Boston on November 14, 2019 appeared first on Collaborative Drug Discovery Inc. (CDD). by Carmelina Maione, CDD
Webpage: https://ift.tt/353pr9Z
Bengaluru: November 14, 2019 at 05:18AM

CDD Vault ELN users may now visualize chemical structures and reactions on the ELN index page.
CDD Vault Update (November 2019): View Chemical Structures and Reactions on the ELN Index Page CDD Vault ELN users may now visualize chemical structures and reactions on the ELN index page. The post CDD Vault Update (November 2019): View Chemical Structures and Reactions on the ELN Index Page appeared first on Collaborative Drug Discovery Inc. (CDD). by Abe Wang, CDD
Webpage: https://ift.tt/32Ee8U0
Bengaluru: November 14, 2019 at 05:18AM

A significant number of CDD Vault subscribers use IC50 values to store and analyze their dose response data from in-vitro assays. Now that the automated calculations extension of CDD Vision supports the calculation of pCI50 values, I’d like to convince users of IC50 to consider using pIC50 instead...
Why using pIC50 instead of IC50 will change your life A significant number of CDD Vault subscribers use IC50 values to store and analyze their dose response data from in-vitro assays. Now that the automated calculations extension of CDD Vision supports the calculation of pCI50 values, I’d like to convince users of IC50 to consider using pIC50 instead, and why it will make your life easier (in the long run), and just make you a finer human being. The post Why using pIC50 instead of IC50 will change your life appeared first on Collaborative Drug Discovery Inc. (CDD). by Anna Coulon Spektor, CDD
Webpage: https://ift.tt/2C0vFL8
Bengaluru: November 02, 2019 at 03:05AM