coordinates = generate_structure_from_smiles(smiles)# Generate molobj from atoms, charge and coordinatesmol = x2m.xyz2mol(atoms, coordinates, charge=charge, use_huckel=True)# For this test, remove chira. clean and canonicalChem.Kekulize(mol) ...
Feigned her smiles to not worry them? For someone who was poisonous, the bitter taste in her mouth was insufferable. ‘It will be over soon.’ Lies and falsehoods won’t end. The lies of how she feels are traded by what she does. She can’t tell them the truth, but she doesn’t...
"MULTIPLE"=>"N","DEFAULT"=>"structure","NAME"=> GetMessage("TP_BSP_STRUCTURE_FILTER"),"PARENT"=>"BASE"),"USE_SUGGEST"=>array("NAME"=> GetMessage("TP_BSP_USE_SUGGEST"),"TYPE"=>"CHECKBOX","DEFAULT"=>"N"),"NAME_TEMPLATE"=>array("TYPE"=>"LIST","NAME"=> GetMessage("TP_BSP_...
aSUPERMOLECULAR STRUCTURE OF NEW COPOLYMER PRODUCTS BASED ON CYCLIC CARBONATES 根据循环碳酸盐的新的共聚物产品SUPERMOLECULAR结构 [translate] aArthur Andersen LL 亚瑟Andersen LL [translate] aa bicycle 一辆自行车 [translate] a我认为如此 I think so [translate] aGive smiles to those who love less but ...
aThe general, I definitely tell you. My English is better than yours. And. You don't go to the group of hair that. Also don't know where you get to come here. Know that is, you write down, or get from where. Don't know, thought you brokenhearted, otherwise is thought you is ...
示例30 def printSmiles(self, smiles): self.limit = sys.getrecursionlimit() sys.setrecursionlimit(10000); self.memo = {} retval = self._printSmiles(smiles, 1, 1) sys.setrecursionlimit(self.limit) return retval 浏览完整代码 来源:EmoticonsDiv2.py 项目:vickyg3/playCopyright...
(9) Charlotte gazes at him without speaking/then smiles and attempts to tell him/that the doctors are trying to make her drunk (H9T 445–447) (10) You and I are going to get filthily drunk, Prentice […] (G0A 2586) Within the BNC, we expected to find the target structures more ...
” Can have a person, may see through my showing off power, may protect my frailty.Before he can falls down in mine tear, uses the big palm of the hand to cover my eye, in a soft voice said the time which my eye only then smiles is most attractive.He can receive in me puts, ...
>Through it all, both Killi and Mia watched her with excited and satisfied smiles respectively. >The palociraptor revealed that she’d been with Mia for a few days and already had been on a quest together with her. And while Sarat revelled in the warmth of their voices, what truly...
from rdkit.Chem import AllChem mol = AllChem.MolFromSmiles('CC') bitInfo = {} fp = AllChem.GetMorganFingerprint(mol, 1, invariants=[], bitInfo=bitInfo) print(bitInfo) bitInfo = {} fp = AllChem.GetMorganFingerprint(mol, 1, invariants=[1,2], bitInfo=bitInfo) print(bitInfo) # ...