🔥The 9th Round of Easy Loan, Earn $40 Reward is in progress❗️ ⏰ Promotion Period: January 15th - Feburary 15th, 2025 👉 Register now and check more details at gate.io/campaigns/358

Super Enzyme!! Faster than a speeding recycling plant! Can break down large plastic buildings in a single bound! amp.theguardian.com/environment/20…

ACS Comp awards for spring 2021 are open. This is my regular reminder, especially to grad students and post-docs, that you don’t win any awards you don’t apply for. Also, remember it is ok to find awards you are eligible for and ask your mentor to nominate you!

Congratulations to Marta Lopez Vidal, a PhD at the Technical University of Denmark, who is the 2021 Michael Wormit Award winner! Congratulations to Marta! We are proud to have you as a part of our team! #compchem

It's not too late! Register for Webinar, "Equation-of-Motion Coupled-Cluster Protocol for Calculating Magnetic Properties of Single-Molecule Magnets," by Dr. Maristella Alessio on March 31, 2022, at 10 a.m. PDT. More info/register: register.gotowebinar.com/register/64978… #compchem

Missing #ACSSpring2022 already? One more day to apply to see us all in Chicago! Submit your abstract here by March 29: acsnm264.abstractcentral.com

This clearly where I get my dance moves from... Comes so naturally! x.com/Chinchillazlll…

Hasta la vista #CompChem Gordon Research Conferences and Castelldefels 🇪🇸! Glad to see Orozco Lab H. Lee Woodcock Alberto Perez Adrian Roitberg 🏳️‍⚧️ Rosana Collepardo Chris de Graaf & listen to Andrew White 🐦‍⬛ Marco De Vivo Paul Robustelli + more! Next time mas tiempo para IRB Barcelona and ¡Barca! Gracias!

Congratulations to our OpenEye Outstanding Junior Faculty Award recipients: William James Glover, Yuanyue Liu, Richard C. Remsing III, and Alexander Yu. Sokolov! And thanks to our sponsor OpenEye, Cadence Molecular Sciences !

Congratulations to S. Jana and J. Herbert on their recent benchmark paper, which compares different methods for computing core-level ionization energies, with potential applications to simulations of core-level spectroscopy. bit.ly/3OUOEv8 #compchem

Q-Chem is still looking for computational scientists to join our core team in Pleasanton, CA! Duties include: ⚛️ Implementation of novel features 📚 Algorithm development 🖥️ Code maintenance Learn more and apply here: bit.ly/3XZxQpW #compchem #ChemJobs

Applications for the COMP awards for the Fall 2024 American Chemical Society National Meeting (August 18-22, 2024, Denver CO) are now open! The deadline for awards applications is Midnight March 10, AoE Learn about our awards here: acscomp.org/awards

We've got one more seminar lined up for you this year! Join us April 30 at 2 pm ET for some computational biochemistry with Dr. Ré Mansbach (Concordia University) and Dr. An Ghysels (Ghent University) cheminst.ca/cic-virtual/se…

It's great to see the new CHARMM at 45 paper published in JPCB... ACS for Authors pubs.acs.org/doi/10.1021/ac…

Some #FEP history. I presented our ethane to methanol calculations at an NSF workshop in Spring 1985 that was attended by Martin Karplus and stat mech folks. Here is a subsequent letter from him and the first page of the draft of JCP 1985, 83, 3050. I sent him the preprint.

It's science... x.com/AMAZlNGNATURE/…