ProtoMS

Monte Carlo biomolecular free energy simulation package. Current release 3.4

[ProtoMS @protoms_mc]

@TenchToyman @sotoncompchem @unisouthampton @ccaveayland @marley_samways @hannahbruce @chryswoods @julienmich80 @Genheden @cmanaisabel

[ProtoMS @protoms_mc]

🥳🥳🥳🥳🥳🥳🥳🥳🥳🥳
New ProtoMS release!! Now onto version 3.4 with lots of new functionality.....
🥳🥳🥳🥳🥳🥳🥳🥳🥳🥳

[ProtoMS @protoms_mc]

From the Prof. Essex Group: @sotoncompchem @unisouthampton. Thanks to all developers current @ccaveayland @marley_samways @hannahbruce and previous @chryswoods @julienmich80 @Genheden @cmanaisabel (+ more...), particularly @ccaveayland for allowing me to add a *couple* of gifs

[ProtoMS @protoms_mc]

Please give it a download (incase you didn't see it above: https://t.co/3qLAkbFeqJ ) and let us know what you think!! Send any questions - we are always happy to help 💪💪💪 and we don't bite

[ProtoMS @protoms_mc]

I feel a new release brewing...

[Chris Cave-Ayland @ccaveayland]

@hannahbruce on the combination of GCMC and FEP to dynamically capture changes in ligand hydration with @protoms_mc #ccpbiosim2017

[ProtoMS @protoms_mc]

It's been awhile but ProtoMS3.3 is out. Revamped, faster gcmc code, now with replica exchange in chemical potential https://t.co/jM0MXtoMvQ

[ProtoMS @protoms_mc]

Presentation of Prof. Essex at the #ACSSanDiego showing output of #ProtoMS simulations as captured by @jchodera https://t.co/YFALZRzFTN

[ProtoMS @protoms_mc]

Are you at the #ACSSanDiego? Did you see the presentation by Prof. Essex? Results proudly obtained with #ProtoMS https://t.co/9JGe7BGM3i

[David Mobley @davidlmobley]

Essex, live project on Chk1. I'm liking how many attempts to close thermodynamic cycles (consistency check) I see lately. #ACSSanDiego

[ProtoMS @protoms_mc]

One of the #ProtoMS developers, Dr. Ross, left @unisouthampton to work with @jchodera at @sloan_kettering. Best wishes, Greg!

[Richard Bradshaw @DrDickieB]

Early Christmas present from @protoms_mc, end of successful dev project with @SoftwareSaved and a release of #ProtoMS version 3.2!

[ProtoMS @protoms_mc]

The new release of #ProtoMS 3.2 is available! It includes a test suite and an optimized (faster) version of the code https://t.co/3qLAkbFeqJ

[ProtoMS @protoms_mc]

#ProtoMS has a new paper on grand canonical Monte Carlo! Interested? Find it @J_A_C_S and https://t.co/f7ljle7KjU

[ProtoMS @protoms_mc]

Last Friday was the Young Modellers' Forum @UniofGreenwich
#ProtoMS was there, next to @astexpharma and @AstraZeneca