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Application

Discovery Studio 0.8972905830292679 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06855962829117192 Amorphous Cell 0.2841507485802788 Blends 0.00247805885389778 CASTEP 0.3896747547754259 CDOCKER 0.15363964894166238 CHARMm 0.24243675787299948 COMPASS 0.36747547754259163 COMPASS III 0.08611254517294786 COSMObase 0.0038203407330924108 COSMOconf 0.004336602994321115 COSMOmic 2.0650490449148167E-4 COSMOperm 0.0013422818791946308 COSMOplex 3.097573567372225E-4 COSMOquick 0.0015487867836861124 COSMOtherm 0.0637067630356221 Cantera 0.0 Catalyst 0.10635002581311306 Classical Simulations 1.0 Conformers 9.292720702116675E-4 Crystallization 0.07475477542591637 DFTB Plus 0.0055756324212700055 DMol3 0.17852348993288591 DPD 0.0026845637583892616 Discover 0.0036138358286009293 Forcite 0.5468249870934435 GULP 0.0247805885389778 Kinetix 3.097573567372225E-4 LUDI 0.0039235931853381515 LibDock 0.06577181208053691 LigandFit 0.004646360351058337 MCSS 7.227671657201859E-4 MODELER 0.1865771812080537 MesoDyn 0.0014455343314403717 Mesocite 0.0039235931853381515 Mesoscale 0.007227671657201859 Modules 0.0 Morphology 0.01734641197728446 ONETEP 0.0010325245224574084 Polymorph 0.001858544140423335 QMERA 2.0650490449148167E-4 QSAR 9.292720702116675E-4 Quantum Mechanics 0.556943727413526 Reflex 0.05482705214248838 Reflex Plus 9.292720702116675E-4 Semi-empirical 0.007330924109447599 Sorption 0.057614868353123384 Synthia 0.0015487867836861124 TURBOMOLE 6.19514713474445E-4 VAMP 0.0013422818791946308 Visualization 0.7629323696437791 X-Cell 0.0013422818791946308 ZDOCK 0.02612287041817243

Year

2022 0.057548845470692715 2023 0.26536412078152755 2024 0.6354351687388987 2025 1.0 2026 0.3775310834813499 2027 0.0

Keywords

target 1.0 potential 0.2791380999020568 docking 0.204841192108577 analysis 0.19196865817825662 visualization 0.18641854391119816 between 0.15899444988573294 novel 0.10036845296394757 energy 0.09467841984982044 cell 0.06557529965953081 binding 0.06366307541625857 promising 0.06105125693764284 activity 0.04645305722680845 stability 0.03927055641061518 performance 0.03773144909285948 interaction 0.03414019868476284 experimental 0.0330674875239028 synthesized 0.0292896786530479 effective 0.020941187444615456 mechanism 0.020381512056340655 including 0.020055034746513687 development 0.019681917820997156 protein 0.01110022853411688 synthesis 0.00923464390653421 design 0.002938295788442703 enhanced 0.0
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