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Application

Discovery Studio 0.908174354020768 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07006735666173813 Amorphous Cell 0.28380154427468374 Blends 0.0027106949236076886 CASTEP 0.4163791687202234 CDOCKER 0.158863150977493 CHARMm 0.2415804172827337 COMPASS 0.3787580088713652 COMPASS III 0.0772958764580253 COSMObase 0.0031214062756694597 COSMOconf 0.0035321176277312307 COSMOmic 2.464268112370626E-4 COSMOperm 0.0013964185970100215 COSMOplex 3.285690816494168E-4 COSMOquick 0.0013142763265976672 COSMOtherm 0.0647281090849351 Cantera 8.21422704123542E-5 Catalyst 0.11721701987842945 Classical Simulations 1.0 Conformers 0.0010678495153606045 Crystallization 0.07573517332019057 DFTB Plus 0.0059963857401018564 DMol3 0.19057006735666174 DPD 0.0030392640052571054 Discover 0.004517824872679481 Forcite 0.5440282569410219 GULP 0.02759980285855101 Kinetix 2.464268112370626E-4 LUDI 0.004517824872679481 LibDock 0.06628881222276983 LigandFit 0.0059963857401018564 MCSS 9.035649745358961E-4 MODELER 0.1720059142434697 MesoDyn 0.0015607031378347298 Mesocite 0.0041071135206177094 Mesoscale 0.007639231148348941 Modules 0.0 Morphology 0.017660588138656154 ONETEP 0.0011499917857729588 Polymorph 0.001971414489896501 QMERA 2.464268112370626E-4 QSAR 0.0012321340561853129 Quantum Mechanics 0.5944636109742073 Reflex 0.055692459339576145 Reflex Plus 7.392804337111878E-4 Semi-empirical 0.008214227041235419 Sorption 0.05651388204369969 Synthia 0.0015607031378347298 TURBOMOLE 5.749958928864794E-4 VAMP 0.0018071299490717923 Visualization 0.8062263840972564 X-Cell 0.0012321340561853129 ZDOCK 0.028339083292262198

Year

2020 0.0 2021 0.052484254723582924 2022 0.2074002799160252 2023 0.40981455563331 2024 0.9343072078376488 2025 1.0 2026 0.3727256822953114 2027 8.747375787263821E-4

Keywords

target 1.0 potential 0.2623397091482198 docking 0.20047997707572177 visualization 0.19324450175514005 analysis 0.17963321154810516 between 0.15627910308761372 novel 0.09588795759008525 energy 0.09191202808224085 binding 0.06221792392005158 cell 0.06060606060606061 promising 0.047997707572175655 activity 0.04405759724908661 interaction 0.03707285622179239 experimental 0.032917830790171215 stability 0.0320581703560427 synthesized 0.027437495522601905 performance 0.026613654273228742 mechanism 0.019091625474604197 effective 0.017945411562432838 development 0.015652983738090123 including 0.010924851350383265 protein 0.01045920194856365 synthesis 0.008918977004083386 chemical 0.0025073429328748478 design 0.0
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