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分类	共搜索到 619 个相关话题(最多显示前5000个)	作者	最后发表

文献求助	Synthesis,DFT study and molecular docking of α-tetralone ... Synthesis,DFTstudyandmoleculardockingofα-tetralonebasedchalconederivativesaspotentialantibacterialandantifungalagentsMilindC.Nagarea,AshishV.Gajbhiyea,RameshS.Nirwanb,...	ygyxyz89	2026-01-30 10:57
文献求助	DFT calculations,in silico molecular docking,predicted p AshaM.Sa,Zabiullaa,HussienAhmedKhameesb,FaresHezamAl-Ostootcd,OthbertPintoa,T.V.Gopichanda,M.ShivappaaaMolecularstructures,DFTcalculations,insilicomoleculardocking,...	ygyxyz89	2026-01-29 10:56
文献求助	Synthesis,anti-leukemia activity,and molecular docking of ... DChen、JHuang、SXiao、GCheng、YLiu、TZhao、CChen、YYi、YPeng、JCaoSynthesis,anti-leukemiaactivity,andmoleculardockingofnovel3,16-androstenedionederivativesSteroids2023vol199,...	埃里克	2026-01-13 07:15
文献求助	Resynthesis,Antimicrobial Evaluation and Molecular Docking ... ShaikhSA,WakchaureSN,MeshramRJ,DeokarSC,MoreRA,NerkarCK,ChobeSS.Resynthesis,AntimicrobialEvaluationandMolecularDockingStudiesofThiazolyl-2-...	独上危楼	2025-12-26 01:35
文献求助	Efficient synthesis and molecular docking of new ... NaglaaF.El-Sayeda,NagwaM.Abdelazeema,AmalGoudaHussienb,MansouraA.Abd-El-Maksouda,BasmaGhazala,MarwaEl-...	袈裟小黑熊	2025-11-08 09:50
文献求助	Synthesis,DFT,ADMET and molecular docking studies of ... MuhammadShahidNadeemSynthesis,DFT,ADMETandmoleculardockingstudiesofthiazolederivedthiazolidinone-basedchalconederivatives:alzheimer\'...	袈裟小黑熊	2025-11-01 02:52
文献求助	Design,synthesis,biological activity,molecular docking,and ... DeryaOsmaniye12,AsafEEvren13,BegümNSa?l?k12,SerkanLevent12,Yusuf?zkay12,ZaferAKaplanc?kl?1Design,synthesis,biologicalactivity,moleculardocking,...	cao184550499	2025-09-09 07:22
文献求助	QSAR Modeling,Virtual Screening and Molecular Docking An SuwenZhou,LuZhou,RuguoCui,YahuiTian,XiaoliLi,RongYouandLiangliangZhongPharmacophore-Based3D-QSARModeling,...	fruit8738	2025-08-16 06:43
文献求助	Mycotoxins aptasensing:From molecular docking to ... HasretSubak等Mycotoxinsaptasensing:FrommoleculardockingtoelectrochemicaldetectionofdeoxynivalenolBioelectrochemistry2021138:107691	云帆沧海?	2025-06-13 07:13
文献求助	Virtual screening,molecular docking and dynamics simulation ... VasaviGarisetti,RoslinElsaVarughese,+3authorsGayathriDasararajuPublishedinJournalofReceptorand…3May2024MedicineVirtualscreening,...	蔡静蔡静	2025-05-19 05:55
文献求助	Application of Network Pharmacology and Molecular Docking to... SongD,YangB,BaoW,WangJ.ApplicationofNetworkPharmacologyandMolecularDockingtoExploretheMechanismofDangguiLiuhuangTangagainstHyperthyroidismCurrComputAidedDrugDes.2024;...	zy120418	2025-04-30 07:21
文献求助	Hirshfeld surface analysis,DFT,and molecular docking s AninditaBhattacharjeea,SubramanyaHegdeb,AbdulMajeedKurumbalac,VinayKumarD?C?d,NagarajaiahHonnappaa,MohdSajidAlie,T.?N.Lohithd,M.?B.MadhusudanaReddyaStructuralelucidation,...	xt_llw	2025-04-25 03:21
文献求助	3D QASR,Antimicrobial Activity and Molecular Docking Studies... YuLong,GanQiu,JamalA.H.Kowah3DQASR,AntimicrobialActivityandMolecularDockingStudiesofC-14ChiralMatrineDerivativesasPotentialAntibioticsChemistry&Biodiversity202516January2025	学生于川	2025-02-12 08:29
待处理贴专版	Diffusion Steps,Twists,and Turns for Molecular Docking GabrieleCorso,HannesSt?rk,BowenJing,ReginaBarzilay,TommiJaakkolaDiffDockiffusionSteps,Twists,andTurnsforMolecularDockingBiomolecules2023...	滴滴大肚肚	2024-10-17 04:38
文献求助	Phytochemical profile,bioactivity,and molecular docking ... OnurFurkanBayram,SarmedMarah,IbrahimTurkekul,TevfikOzenPhytochemicalprofile,bioactivity,...	小义2010	2024-09-13 07:19
文献求助	求助文献The Art and Science of Molecular Docking JosephM.Paggi，AyushPandit，RonO.DrorTheArtandScienceofMolecularDockingAnnualReviewofBiochemistry20241-110.1146/annurev-biochem-030222-120000...	大城小事	2024-06-14 05:54
文献求助	Molecular Docking of Pharmaceutical Cocrystal As a Ligand:Do... Roy,Parag,NoopurPandey,andAnimeshGhosh."MolecularDockingofPharmaceuticalCocrystalAsaLigandoWeNeedtoRethink?CrystalGrowth&Design23.1(2022):1-5.CrystalGrowth&Design23.1(2022):...	hanyunch	2024-04-13 02:25
文献求助	Design,Synthesis,Molecular Docking,and Biological Evaluation... NaderRAlbujuq1,JJavierMeana234,RebecaDiez-Alarcia234,ItziarMuneta-Arrate23,ArshiNaqvi5,KhalidAlthumayri5,MosaAlsehli5Design,Synthesis,MolecularDocking,...	wenjuanone	2024-04-07 07:16
文献求助	Integrated multispectroscopic analysis and molecular docking... 无Integratedmultispectroscopicanalysisandmoleculardockinganalysesofthestructure-affinityrelationshipandmechanismoftheFoodChemistry无无ScienceDirect(Elsevier)(CellPress)	九二九四	2024-02-18 06:59
文献求助	Spectroscopy and molecular docking analysis reveal ... 无Spectroscopyandmoleculardockinganalysisrevealstructuralspecificityofflavonoidsintheinhibitionofα-glucosidaseactivity无无无ScienceDirect(Elsevier)(CellPress)	云销雨霁，	2024-02-07 05:22
文献求助	Identification and molecular docking of tyrosinase ... ZhipengYu,HongLv,MingjieZhou,PengchengFu,...	小义2010	2024-01-28 03:24
绿色求助(高悬赏)	learning methods for ligand–protein molecular docking KevinCramponMachine-learningmethodsforligand–proteinmoleculardockingDrugDiscoveryToday2022inpress	martha_ok	2024-01-17 03:19
文献求助	求助文献:Synthesis,molecular modeling,and docking studies of... MahaS.A.Abdelrahman,FouzM.Omar,AkilaA.Saleh,MosadA.El-ghamrySynthesis,molecularmodeling,anddockingstudiesofanewpyridazinone-acidhydrazoneligand,anditsnanometalcomplexes....	whodo163	2023-12-21 09:58
文献求助	Network Pharmacology and Molecular Docking Analysis on ... Yun-ChaoZhang1,Wen-CangGao2,Wei-JianChen2,De-XiangPang2,Da-YuMo3,MinYang2...	tanjuan135	2023-11-13 10:46
文献求助	Network pharmacology prediction and molecular docking-based ... LiX,WeiS,NiuS,MaX,LiH,JingM,ZhaoY.Networkpharmacologypredictionandmoleculardocking-...	cxz265	2023-11-10 01:16