Greg Landrum cbd8928642 improve error reporting for smiles, smarts, and sln parsers ...

(sf.net issue 3302363)

2011-05-15 10:10:56 +00:00

..

Catalogs

remove exe property from source files

2011-01-13 04:22:56 +00:00

ChemicalFeatures

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

cmake/Modules

start adding support for cpack; update copyright in license.txt

2011-05-09 03:39:40 +00:00

DataManip

remove exe property from source files

2011-01-13 04:22:56 +00:00

DataStructs

fix and tests issue 3295215

2011-04-30 03:15:46 +00:00

Demos

move the _VSA descriptors into C++

2011-03-21 05:02:12 +00:00

DistGeom

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

Features

update copyright statements

2010-09-26 17:04:37 +00:00

ForceField

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

Geometry

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

GraphMol

improve error reporting for smiles, smarts, and sln parsers

2011-05-15 10:10:56 +00:00

JavaWrappers

remove

2011-04-28 05:21:19 +00:00

ML

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

Numerics

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

PgSQL

update cartridge build

2011-04-20 03:16:09 +00:00

Query

remove exe property from source files

2011-01-13 04:22:56 +00:00

RDBoost

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

RDGeneral

checkin some fragment and fingerprint changes. these are not yet well tested

2011-01-14 06:24:03 +00:00

SimDivPickers

remove the bjam-based build system

2010-09-27 03:54:07 +00:00

CMakeLists.txt

add initial version of new swig wrappers

2011-04-07 05:22:00 +00:00

doxygen.config

(re)organize some of the documentation

2008-07-14 03:53:20 +00:00

notes.txt

initial import

2006-05-06 22:20:08 +00:00

test_list.py

get geometry tests working on mac and include them in the default build

2009-10-02 10:12:46 +00:00