Pavlo O. Dral
@pavlodral.bsky.social
Prof. at Xiamen University and NCU in Torun, co-founder of Aitomistic.
Researcher and educator in AI-enhanced computational chemistry.
All opinions expressed are mine and do not necessarily reflect those of my employers.
Researcher and educator in AI-enhanced computational chemistry.
All opinions expressed are mine and do not necessarily reflect those of my employers.
Thank you very much for a nice piece!
January 9, 2026 at 7:01 AM
Thank you very much for a nice piece!
same for our AIQM methods which are based on xTB
October 25, 2025 at 6:59 AM
same for our AIQM methods which are based on xTB
2/2 If you are interested in the course on @aitomistic.com , it is available online for free for academic users. You can also pre-register for a living & course with webinars. See more at aitomistic.com/en/sub/course
#compchem #mlchem #aichem
#compchem #mlchem #aichem
Aitomistic
aitomistic.com
October 1, 2025 at 6:22 AM
2/2 If you are interested in the course on @aitomistic.com , it is available online for free for academic users. You can also pre-register for a living & course with webinars. See more at aitomistic.com/en/sub/course
#compchem #mlchem #aichem
#compchem #mlchem #aichem
Thank you for sharing!
You can run #compchem simulations with AIQM2 as described in our tutorials: mlatom.com/docs/tutoria...
Also, online via a web browser on @aitomistic.com Hub at aitomistic.xyz (free)
You can run #compchem simulations with AIQM2 as described in our tutorials: mlatom.com/docs/tutoria...
Also, online via a web browser on @aitomistic.com Hub at aitomistic.xyz (free)
AIQM2 — MLatom @XACS documentation
mlatom.com
September 21, 2025 at 5:36 AM
Thank you for sharing!
You can run #compchem simulations with AIQM2 as described in our tutorials: mlatom.com/docs/tutoria...
Also, online via a web browser on @aitomistic.com Hub at aitomistic.xyz (free)
You can run #compchem simulations with AIQM2 as described in our tutorials: mlatom.com/docs/tutoria...
Also, online via a web browser on @aitomistic.com Hub at aitomistic.xyz (free)