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switching to an SSS fp size of 2048; this helps a lot with ChEMBL queries

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Greg Landrum
2013-03-28 15:08:42 +00:00
parent d07a674fa4
commit 2aedb4c777
1 changed files with 1 additions and 1 deletions
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Code/PgSQL/rdkit/adapter.cpp
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@@ -53,7 +53,7 @@
using namespace std;
using namespace RDKit;
const unsigned int SSS_FP_SIZE=1024;
const unsigned int SSS_FP_SIZE=2048;
const unsigned int LAYERED_FP_SIZE=1024;
const unsigned int MORGAN_FP_SIZE=512;
const unsigned int HASHED_TORSION_FP_SIZE=1024;