2007.07.20 : fixed bug : MPEOE charge
2007.07.20 : fixed bug : MPEOE charge We fixed atomic [...]
2006.10.27 : modifed druglikeness calculation
2006.10.27 : modifed druglikeness calculation if AlogP98 atomic types is missing, this case [...]
2006.09.30 : Added several kinds of descriptors
2006.09.30 : Added several kinds of descriptors No. of rings [...]
2006.07.20 : Added Maximum partial charge of several elements
2006.07.20 : Added Maximum partial charge of several elements
2006.07.13 : Fixed bug of reactive functiona groups
2006.07.13 : Fixed bug of reactive functiona groups ring correction [...]
2006.07.10 : Fixed bug of Xu descriptors and added reactive functional groups
2006.07.10 : Fixed bug of Xu descriptors and added reactive functional [...]
2006.03.08 : Added two kinds of toxicity models and changed 2D structure drawer
2006.03.08 : Added two kinds of toxicity models and changed [...]
2006.02.02 : Fixed bug on calculation of hydrogen number
2006.02.02 : Fixed bug on calculation of hydrogen number Element [...]
2006.01.05 : Fixed bug of autocorrelation geary descriptor
2006.01.05 : Fixed bug of autocorrelation geary descriptor
2006.01.04 : Fixed bug of misclassified functional group
2006.01.04 : Fixed bug of misclassified functional group amine, ether, [...]