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Application

Discovery Studio 0.9696555494805905 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06289308176100629 Amorphous Cell 0.2816590175080741 Blends 0.0016998130205677375 CASTEP 0.3421723610402856 CDOCKER 0.16284208737038924 CHARMm 0.26381098079211285 COMPASS 0.3447220805711372 COMPASS III 0.10113887472378039 COSMObase 0.004419513853476118 COSMOconf 0.0056093829678735335 COSMOmic 0.0 COSMOperm 5.099439061703213E-4 COSMOplex 1.6998130205677376E-4 COSMOquick 0.00135985041645419 COSMOtherm 0.06459289478157403 Catalyst 0.08669046404895461 Classical Simulations 1.0 Conformers 3.399626041135475E-4 Crystallization 0.07105218425973144 DFTB Plus 0.004249532551419344 DMol3 0.15434302226755056 DPD 0.002209756926738059 Discover 0.0035696073431922487 Forcite 0.5330613632500425 GULP 0.019207887132415433 Kinetix 1.6998130205677376E-4 LUDI 0.0035696073431922487 LibDock 0.0693523712391637 LigandFit 0.00407955124936257 MCSS 5.099439061703213E-4 MODELER 0.24715281319054905 MesoDyn 6.79925208227095E-4 Mesocite 0.0032296447390787013 Mesoscale 0.005779364269930308 Modules 0.0 Morphology 0.016148223695393506 ONETEP 8.499065102838688E-4 Polymorph 0.0016998130205677375 QMERA 1.6998130205677376E-4 QSAR 5.099439061703213E-4 Quantum Mechanics 0.48733639299677034 Reflex 0.051844297127315996 Reflex Plus 0.0010198878123406426 Semi-empirical 0.005779364269930308 Sorption 0.0543940166581676 Synthia 0.0010198878123406426 TURBOMOLE 1.6998130205677376E-4 VAMP 0.0010198878123406426 Visualization 0.7095019547849737 X-Cell 0.0016998130205677375 ZDOCK 0.02855685874553799

Year

2023 0.020342612419700215 2024 0.4943790149892934 2025 1.0 2026 0.5678533190578159 2027 0.0

Keywords

target 1.0 potential 0.2964187772221326 docking 0.21447007581868044 analysis 0.20842071301822876 visualization 0.16623648975641234 between 0.14954024842716568 novel 0.09485400871108243 energy 0.08017422164865301 promising 0.0779964510404904 binding 0.07089853202129376 cell 0.062268107759316016 activity 0.04581384094208743 stability 0.04153895789643491 performance 0.03871592192289079 including 0.021132440716244556 effective 0.01798677206000968 experimental 0.017583481206646233 synthesized 0.01669624132924665 development 0.01508307791579287 interaction 0.014599128891756736 mechanism 0.014276496209065978 enhanced 0.00846910792063236 protein 0.005484755605742862 strong 9.678980480722697E-4 design 0.0
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