Hassan

running moltemplate on large systems is slow and needs a lot of memory

5

Hi andrew, I have a martini based coursegrain simulation in which the size of the box is large. There are 3 species of atoms totaling around 12million atoms. Moltemplate always...

Stuck with 600aa protein

2

12th Gen Intel(R) Core(TM) i9-12900K NVIDIA GeForce RTX 4090 Ubuntu 22.04 64bit Hello! 1. I have to run Boltz iteratively for different sequences (all size 600aa), but it gets stuck...