嘉宾:邬知易博士,牛津大学
主持人:于浩然
时间:2019年8月20日晚8点
摘要:
随着计算成本的不断降低与蛋白质结构的获得越来越方便,计算机辅助的药物设计变得越来越流行。过去人们普遍认为,和蛋白质结合能越高,结合的越紧密的药物,越有可能成为一个优秀的药物。虽然人们现在已经意识到这是一种太过天真的想法,但若可以算准药物和蛋白质的结合能,对于新药的研发仍然是非常有利的。虽然小分子和蛋白质的结合能可以采用伞状采样或自由能微扰的方法来计算,但计算结果和实验结果之间往往还是有不小的误差。我将会从蛋白质构象,小分子和蛋白质的质子化状态以及小分子本身的亲疏水性的角度来讲解如何可以提升结合能计算的准确性。
buy famvir 500mg – zovirax 800mg without prescription buy valcivir 1000mg generic
buy ketoconazole online – order lotrisone online sporanox 100mg sale
lamisil generic – how to buy fluconazole order griseofulvin sale
CfTHDmUgGlzB
glucophage 1000mg pills – buy januvia 100 mg generic buy precose without prescription
buy micronase medication – buy actos generic dapagliflozin 10mg drug
clarinex uk – aristocort 4mg cheap purchase ventolin inhalator for sale
medrol 4mg otc – astelin 10ml price azelastine without prescription
ivermectin 6 mg stromectol – eryc uk buy cefaclor generic
cleocin 300mg pills – purchase chloromycetin pill chloramphenicol drug
buy zithromax 500mg sale – buy generic sumycin ciprofloxacin 500mg canada
order amoxicillin generic – purchase keflex without prescription buy baycip cheap
amoxiclav canada – buy bactrim for sale order cipro 500mg online cheap
TdJLajygi
hydroxyzine 10mg cost – buy pamelor 25 mg generic cheap endep
order anafranil 25mg generic – buy remeron 30mg pill brand doxepin 75mg
order quetiapine 100mg without prescription – brand ziprasidone 40mg buy eskalith generic
clozaril canada – famotidine 40mg brand where to buy famotidine without a prescription
zidovudine online – order roxithromycin online zyloprim 300mg brand
generic glucophage 1000mg – lincomycin 500 mg tablet lincomycin brand
furosemide 40mg cheap – buy atacand 16mg online captopril price
flagyl oral – oxytetracycline 250 mg canada order zithromax 500mg pills
buy acillin without prescription order amoxil for sale buy amoxicillin sale
order valacyclovir 500mg online – purchase mebendazole sale acyclovir 800mg price
ivermectin cost in usa – cefuroxime 250mg ca sumycin 250mg cost
buy metronidazole pill – oxytetracycline for sale online buy azithromycin paypal
ciprofloxacin 500 mg canada – how to get doxycycline without a prescription order erythromycin 500mg pill
buy ciprofloxacin without a prescription – buy bactrim 960mg pills order augmentin
buy baycip pill – order keflex 250mg pill cost augmentin
order atorvastatin 80mg pill atorvastatin 40mg cost purchase lipitor sale