Re: [Open Babel] Join sdf files

2010-08-27 Thread Chris Morley
On 25/08/2010 11:44, Pascal Muller wrote: > Hello, > > I would like to merge several sdf files (2D). Some molecules are in > duplicates (same id), but may share different sdf fields, or same > field, but with different values. > Eg, a molecule will be present 2 times, with these fields: > > = 12

[Open Babel] Join sdf files

2010-08-25 Thread Pascal Muller
Hello, I would like to merge several sdf files (2D). Some molecules are in duplicates (same id), but may share different sdf fields, or same field, but with different values. Eg, a molecule will be present 2 times, with these fields: = 12 for the first occurence, and for the 2nd occurence (t