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Hi,
there is a plan to add the support for the Vinardo and AD4 scoring funtions?
Thanks.
Saverio
PS: Vina GPU is very fast.
For about 10000 molecules the cpu version of Vina 1.2.5 needs about 26 hours
with a Ryzen 9 16C/32T ( exhaustiveness 32 ) whereas for the same drugs with an
old RTX 2080 Ti , used for the monitor therefore not completely dedicated to the
docking , it completes the run in 6 hours.
The text was updated successfully, but these errors were encountered:
Hi,
there is a plan to add the support for the Vinardo and AD4 scoring funtions?
Thanks.
Saverio
PS: Vina GPU is very fast.
For about 10000 molecules the cpu version of Vina 1.2.5 needs about 26 hours
with a Ryzen 9 16C/32T ( exhaustiveness 32 ) whereas for the same drugs with an
old RTX 2080 Ti , used for the monitor therefore not completely dedicated to the
docking , it completes the run in 6 hours.
The text was updated successfully, but these errors were encountered: