[CP2K-user] [CP2K:18902] ConstuQt

Peter Jarowski p.jarowski at chemalive.com
Wed Jun 7 11:19:51 UTC 2023


ConstruQt - Library-scale Quantum Mechanics as a Frontend Service
Dear Cp2K Community:

We have developed a SaaS for quantum chemistry that relies heavily on 
cp2k's semi-empirical modules and as such we thought to invite the cp2k 
community to our upcoming webinar. The *ConstruQt* 
<http://construqt.chemalive.com/?utm_source=hs_email&utm_medium=email&_hsenc=p2ANqtz--SleXcBNUeII9llkThC7hScJgrc5itT7q4fcx7Yji8tYgVJMsR6KuBGfci_dW0eyyEKJPk>
 frontend would prove useful, even to expert comp. chemists, as it allows 
quick and easy, structure optimization at a library scale from SMILES only 
- think initial guess structure for follow-on computation.

We will be running a series of webinars starting this week to explain the 
best way to use the SaaS to help get you started. Please sign-up here 
<http://4946522.hs-sites.com/sign-up-to-attend-our-construqt-webinar?utm_source=hs_email&utm_medium=email&_hsenc=p2ANqtz--SleXcBNUeII9llkThC7hScJgrc5itT7q4fcx7Yji8tYgVJMsR6KuBGfci_dW0eyyEKJPk>
.

[image: Screen Shot 2023-06-05 at 14.14.48]





 
We hope to see you there. We would also be delighted to set up individual 
meetings to show what ConstruQt can do for you and your team by contacting 
<info at chemalive.com?subject=ChemAlive> us. 
 
Best regards,
Peter Jarowski, PhD
Co-founder and Director
The ChemAlive Team
info at chemalive.com

ChemAlive 
<http://www.chemalive.com/?utm_source=hs_email&utm_medium=email&_hsenc=p2ANqtz--SleXcBNUeII9llkThC7hScJgrc5itT7q4fcx7Yji8tYgVJMsR6KuBGfci_dW0eyyEKJPk>
 is leading in innovative digital chemistry solutions with focus on physics 
based predictive analytics and the development of new software tools to 
drive chemical discovery.

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