download vers. 1.4.30 drawmol on 10.11.4

Main category - Education
Sub category - Science
Developer - UNamur
Filesize - 21811
Title - DrawMol


https://bitly.com/2X2dca4 DrawMol version 1.4.30

UPV - Universitat Politècnica de València
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DrawMol is a powerful graphic interface to visualize and build molecular structures. This app is exclusively available on Mac from macOS 10.10 Yosemite and later on the mac App Store.
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Recomended! version https://macpkg.icu/?id=59320&kw=1.1.55.DrawMol.LPlBPZ.tar.gz {25300 kbytes}
Version to MacOS https://macpkg.icu/?id=59320&kw=DRAWMOL_V.1.3.160_ROONQP.DMG {26173 kbytes}


Philipps-University Marburg
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Added support for implicit hydrogen overrides to all capable formats.
• Minor bug fixes and improvements
Lowlander II: Lowerlander
Dipole moment vector
:-) It happens. On Sat, Feb 1, 2014 at 3:54 PM, Alexey Chernobrovkin wrote: > Thanks, Greg. > > You are right. I spent too much time with Python and forgot how to build > real programs :) > > Alex > > On 01 Feb 2014, at 14:37, Greg Landrum wrote: > > Hi Alexey, > > It kind of looks like you aren't linking against any of the RDKit > libraries. > Based on the errors above, I'd guess you need at least > -lSmilesParse -lDepictor -lGraphMol -lDataStructs -lRDGeometryLib > -lRDGeneral > > -greg > > > > On Fri, Jan 31, 2014 at 10:28 AM, Alexey Chernobrovkin chernobrovkin@...> wrote: > >> Dear all, >> >> I've just tried to build simple GUI in Xcode using rdkit libraries. >> Unfortunately I've got link errors. I tried to use homebrew installed >> version, also compiled sources from github by myself. Any idea? >> >> PS >> Python bindings work perfectly on my computer. >> If I don' include MolDrowing.h and DrawingToSVG.h project is linked >> without errors. >> >> simple code: >> >> #include "testmol.h" >> #include >> #include >> #include >> #include >> #include >> >> #include >> //#include >> >> >> Error listing: >> >> Ld >> /Users/black/Library/Developer/Xcode/DerivedData/SMILES_Viewer-ftbnkyhvxqageqflovukoyyuiamy/Build/Products/Debug/SMILES\ >> \ Viewer normal x86_64 >> cd "/Users/black/projects/SMILES Viewer" >> setenv MACOSX_DEPLOYMENT_TARGET 10.9 >> >> /Applications/ >> -arch x86_64 -isysroot >> /Applications/ >> -L/Users/black/Library/Developer/Xcode/DerivedData/SMILES_Viewer-ftbnkyhvxqageqflovukoyyuiamy/Build/Products/Debug >> -L/Users/black/projects/rdkit/build/lib >> -L/usr/local/Cellar/boost/1.54.0/lib >> -F/Users/black/Library/Developer/Xcode/DerivedData/SMILES_Viewer-ftbnkyhvxqageqflovukoyyuiamy/Build/Products/Debug >> -filelist >> /Users/black/Library/Developer/Xcode/DerivedData/SMILES_Viewer-ftbnkyhvxqageqflovukoyyuiamy/Build/Intermediates/SMILES\ >> \ \ >> nkFileList -mmacosx-version-min=10.9 -fobjc-arc >> -fobjc-link-runtime -stdlib=libstdc++ -framework Cocoa -Xlinker >> -dependency_info -Xlinker >> /Users/black/Library/Developer/Xcode/DerivedData/SMILES_Viewer-ftbnkyhvxqageqflovukoyyuiamy/Build/Intermediates/SMILES\ >> \ \ >> -o >> /Users/black/Library/Developer/Xcode/DerivedData/SMILES_Viewer-ftbnkyhvxqageqflovukoyyuiamy/Build/Products/Debug/SMILES\ >> \ Viewer >> >> Undefined symbols for architecture x86_64: >> "Invar::operator> RDGeom::Point3D::operator[](unsigned int) const in testmol.o >> RDGeom::Point3D::operator[](unsigned int) in testmol.o >> RDGeom::Point2D::operator[](unsigned int) const in testmol.o >> RDGeom::Point2D::operator[](unsigned int) in testmol.o >> "RDKit::ROMol::initFromOther(RDKit::ROMol const&, bool)", referenced >> from: >> RDKit::RWMol::RWMol(RDKit::ROMol const&, bool) in testmol.o >> "RDKit::ROMol::initMol()", referenced from: >> RDKit::ROMol::ROMol() in testmol.o >> "RDKit::MolOps::Kekulize(RDKit::RWMol&, bool, unsigned int)", >> referenced from: >> RDKit::Drawing::MolToDrawing(RDKit::ROMol const&, std::vector> std::allocator > const*, bool) in testmol.o >> "RDKit::MolOps::findSSSR(RDKit::ROMol const&, >> std::vector >, >> std::allocator > > >*)", referenced >> from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDLog::toStream(std::ostream&)", referenced from: >> RDGeom::Point3D::operator[](unsigned int) const in testmol.o >> RDGeom::Point3D::operator[](unsigned int) in testmol.o >> RDGeom::Point2D::operator[](unsigned int) const in testmol.o >> RDGeom::Point2D::operator[](unsigned int) in testmol.o >> "RDGeom::operator/(RDGeom::Point2D const&, double)", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDGeom::operator-(RDGeom::Point2D const&, RDGeom::Point2D const&)", >> referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDGeom::operator*(RDGeom::Point2D const&, double)", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDGeom::operator+(RDGeom::Point2D const&, RDGeom::Point2D const&)", >> referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDDepict::compute2DCoords(RDKit::ROMol&, std::map> RDGeom::Point2D, std::less, std::allocator> RDGeom::Point2D> > > const*, bool, bool, unsigned int, unsigned int, int, >> bool)", referenced from: >> RDKit::Drawing::MolToDrawing(RDKit::ROMol const&, std::vector> std::allocator > const*, bool) in testmol.o >> "RDKit::Atom::getTotalNumHs(bool) const", referenced from: >> RDKit::Drawing::detail::getAtomSymbolAndOrientation(RDKit::Atom >> const&, RDGeom::Point2D) in testmol.o >> "RDKit::Atom::getDegree() const", referenced from: >> RDKit::Drawing::detail::getAtomSymbolAndOrientation(RDKit::Atom >> const&, RDGeom::Point2D) in testmol.o >> "RDKit::Atom::getSymbol() const", referenced from: >> RDKit::Drawing::detail::getAtomSymbolAndOrientation(RDKit::Atom >> const&, RDGeom::Point2D) in testmol.o >> "RDKit::Bond::getOtherAtomIdx(unsigned int) const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDKit::Dict::getVal(std::string const&, std::string&) const", >> referenced from: >> std::string RDKit::Dict::getVal(char const*, >> std::string&) const in testmol.o >> "RDKit::ROMol::getNumAtoms(bool) const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDKit::ROMol::getVertices() const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDKit::ROMol::getAtomBonds(RDKit::Atom const*) const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDKit::ROMol::getConformer(int) const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDKit::ROMol::getAtomWithIdx(unsigned int) const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDKit::RingInfo::numBondRings(unsigned int) const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "RDKit::Conformer::getPositions() const", referenced from: >> RDKit::Drawing::DrawMol(RDKit::ROMol const&, int, std::vector> std::allocator > const*, unsigned int, double, double, double) in >> testmol.o >> "vtable for RDKit::ROMol", referenced from: >> RDKit::ROMol::ROMol() in testmol.o >> RDKit::ROMol::~ROMol() in testmol.o >> NOTE: a missing vtable usually means the first non-inline virtual >> member function has no definition. >> "vtable for RDKit::RWMol", referenced from: >> RDKit::RWMol::RWMol(RDKit::ROMol const&, bool) in testmol.o >> NOTE: a missing vtable usually means the first non-inline virtual >> member function has no definition. >> "_rdErrorLog", referenced from: >> RDGeom::Point3D::operator[](unsigned int) const in testmol.o >> RDGeom::Point3D::operator[](unsigned int) in testmol.o >> RDGeom::Point2D::operator[](unsigned int) const in testmol.o >> RDGeom::Point2D::operator[](unsigned int) in testmol.o >> ld: symbol(s) not found for architecture x86_64 >> clang: error: linker command failed with exit code 1 (use -v to see >> invocation) >> >> >> >> ------------------------------------------------------------------------------ >> WatchGuard Dimension instantly turns raw network data into actionable >> security intelligence. It gives you real-time visual feedback on key >> security issues and trends. Skip the complicated setup - simply import >> a virtual appliance and go from zero to informed in seconds. >> >> >> _______________________________________________ >> Rdkit-discuss mailing list >> Rdkit-discuss@... >> >> >> >
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