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Application

Discovery Studio 0.5294767056745419 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05127737226277372 Amorphous Cell 0.1864963503649635 Antibody 0.0 Blends 0.004379562043795621 CASTEP 0.6427007299270073 CDOCKER 0.11678832116788321 CHARMm 0.20018248175182482 COMPASS 0.33138686131386863 COMPASS III 0.015328467153284672 COSMObase 5.474452554744526E-4 COSMOconf 0.0023722627737226276 COSMOmic 0.0012773722627737226 COSMOperm 9.124087591240876E-4 COSMOplex 5.474452554744526E-4 COSMOquick 0.0020072992700729928 COSMOtherm 0.08813868613138687 Catalyst 0.1375912408759124 Classical Simulations 0.8833941605839416 Conformers 0.0031021897810218978 Crystallization 0.08667883211678833 DFTB Plus 0.0051094890510948905 DMol3 0.37244525547445256 DPD 0.014963503649635036 Discover 0.04598540145985401 Forcite 0.347992700729927 GULP 0.10748175182481752 Kinetix 0.0 LUDI 0.011313868613138687 LibDock 0.04343065693430657 LigandFit 0.025182481751824817 MCSS 0.0018248175182481751 MODELER 0.21094890510948905 MesoDyn 0.006934306569343066 Mesocite 0.00583941605839416 Mesoscale 0.02427007299270073 Morphology 0.02208029197080292 ONETEP 0.004744525547445255 Polymorph 0.004562043795620438 QMERA 1.824817518248175E-4 QSAR 0.004379562043795621 Quantum Mechanics 1.0 Reflex 0.05802919708029197 Reflex Plus 0.004562043795620438 Semi-empirical 0.011496350364963503 Sorption 0.037043795620437955 Synthia 0.002737226277372263 TURBOMOLE 0.0021897810218978104 VAMP 0.0056569343065693434 Visualization 0.5235401459854014 X-Cell 0.004744525547445255 ZDOCK 0.021532846715328468

Year

2000 0.0 2001 0.021170610211706103 2002 0.030510585305105854 2003 0.0323785803237858 2004 0.0460772104607721 2005 0.0547945205479452 2006 0.08156911581569116 2007 0.09277708592777086 2008 0.12826899128268993 2009 0.1519302615193026 2010 0.20610211706102116 2011 0.26650062266500624 2012 0.30323785803237857 2013 0.3480697384806974 2014 0.3592777085927771 2015 0.43088418430884184 2016 0.4122042341220423 2017 0.4657534246575342 2018 0.5398505603985057 2019 0.5722291407222914 2020 0.6450809464508095 2021 0.7652552926525529 2022 0.797011207970112 2023 0.861145703611457 2024 1.0 2025 0.7864259028642591 2026 0.13885429638854296

Keywords

well 1.0 target 0.9483966089200148 between 0.2068558791006266 experimental 0.16004423147806857 potential 0.15753778105418356 energy 0.12841872465904902 analysis 0.11581275340950976 docking 0.09104312569111685 visualization 0.08271286398820495 chemical 0.06384076667895319 novel 0.05941761887209731 interaction 0.052340582381127904 binding 0.05057132325838555 cell 0.03501658680427571 surface 0.03457427202359012 activity 0.025801695539992626 synthesized 0.01820862513822337 including 0.017323995576852193 mechanism 0.016586804275709546 higher 0.007814227792112053 protein 0.004496866936970143 promising 0.00427570954662735 applied 0.0024327312937707335 design 7.371913011426465E-5 role 0.0
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