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From: Геннадий М. <fto...@ma...> - 2017-09-20 11:26:56
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Dear OpenBabel users and developers, I have downloaded and builded newest OpenBabel 2.4.1. If I want to build 3D-structure of molecule by babel command such as babel -ismi test.smi -oxyz test.xyz -h --gen3D babel will use all cores of my machine. It is not optimal for small molecule and, as a result, very slow. Can I build non-parallelized OpenBabel or set maximum quantity of used threads? |