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Application

Discovery Studio 1.0 Materials Studio 0.4230944082436733 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.049274568847522585 Amorphous Cell 0.10867779906925815 Antibody 0.0 Blends 5.474952094169176E-4 CASTEP 0.2918149466192171 CDOCKER 0.2504790583082398 CHARMm 0.37448672324117166 COMPASS 0.1801259238981659 COMPASS III 0.0358609362168081 COSMObase 0.0016424856282507528 COSMOconf 0.0024637284423761293 COSMOperm 5.474952094169176E-4 COSMOquick 0.0010949904188338351 COSMOtherm 0.05228579249931563 Cantera 0.0 Catalyst 0.1853271283876266 Classical Simulations 0.7459622228305502 Conformers 0.001368738023542294 Crystallization 0.03640843142622502 DFTB Plus 0.0024637284423761293 DMol3 0.13632630714481248 DPD 0.001368738023542294 Discover 0.0038324664659184233 Forcite 0.24938406788940598 GULP 0.019709827539009035 Kinetix 0.0 LUDI 0.008486175745962223 LibDock 0.10621407062688201 LigandFit 0.015603613468382151 MCSS 0.0010949904188338351 MODELER 0.29455242266630166 MesoDyn 8.212428141253764E-4 Mesocite 5.474952094169176E-4 Mesoscale 0.0024637284423761293 Morphology 0.009581166164796057 ONETEP 8.212428141253764E-4 Polymorph 0.0016424856282507528 QMERA 5.474952094169176E-4 QSAR 8.212428141253764E-4 Quantum Mechanics 0.4180125923898166 Reflex 0.025458527237886667 Reflex Plus 0.0 Semi-empirical 0.004927456884752259 Sorption 0.03202846975088968 Synthia 0.0 VAMP 0.001368738023542294 Visualization 1.0 X-Cell 5.474952094169176E-4 ZDOCK 0.030933479332055844

Year

2016 0.0 2017 0.020191649555099247 2018 0.0971937029431896 2019 0.1300479123887748 2020 0.15468856947296372 2021 0.21765913757700206 2022 0.33915126625598907 2023 0.4791238877481177 2024 0.7084188911704312 2025 1.0 2026 0.26591375770020537 2027 3.4223134839151266E-4

Keywords

potential 1.0 target 0.953017708709794 docking 0.35814962052764726 visualization 0.2396096855800506 analysis 0.23057462956270328 novel 0.12974340440910734 binding 0.12612938200216842 activity 0.08119503674256114 promising 0.07806288398988073 between 0.07637634019997591 protein 0.057824358511022765 drug 0.04601855198168895 therapeutic 0.03650162631008312 silico 0.03276713648957957 vitro 0.032164799421756415 inhibition 0.025780026502830983 compound 0.02481628719431394 treatment 0.020840862546681122 interaction 0.0203589928924226 development 0.01734730755330683 including 0.014817491868449585 stability 0.009878327912299723 energy 0.0014456089627755693 synthesized 6.023370678231539E-4 effective 0.0
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