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Application

Discovery Studio 1.0 Materials Studio 0.9501740245466203 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05747126436781609 Amorphous Cell 0.27873563218390807 Blends 0.0016762452107279694 CASTEP 0.3388409961685824 CDOCKER 0.17097701149425287 CHARMm 0.26053639846743293 COMPASS 0.35201149425287354 COMPASS III 0.10129310344827586 COSMObase 0.0040708812260536395 COSMOconf 0.0059865900383141765 COSMOmic 2.3946360153256704E-4 COSMOperm 0.0011973180076628352 COSMOplex 2.3946360153256704E-4 COSMOquick 9.578544061302681E-4 COSMOtherm 0.06704980842911877 Catalyst 0.10727969348659004 Classical Simulations 1.0 Conformers 2.3946360153256704E-4 Crystallization 0.07303639846743296 DFTB Plus 0.0059865900383141765 DMol3 0.15756704980842912 DPD 0.0028735632183908046 Discover 0.0031130268199233715 Forcite 0.5342432950191571 GULP 0.019875478927203066 Kinetix 2.3946360153256704E-4 LUDI 0.0026340996168582377 LibDock 0.07064176245210728 LigandFit 0.0040708812260536395 MODELER 0.23227969348659003 MesoDyn 2.3946360153256704E-4 Mesocite 0.0026340996168582377 Mesoscale 0.005747126436781609 Modules 0.0 Morphology 0.018199233716475097 ONETEP 0.0014367816091954023 Polymorph 0.0019157088122605363 QMERA 0.0 QSAR 4.789272030651341E-4 Quantum Mechanics 0.4873084291187739 Reflex 0.05148467432950191 Reflex Plus 0.0014367816091954023 Semi-empirical 0.007183908045977011 Sorption 0.0617816091954023 Synthia 0.0021551724137931034 TURBOMOLE 2.3946360153256704E-4 VAMP 7.183908045977011E-4 Visualization 0.8084291187739464 X-Cell 7.183908045977011E-4 ZDOCK 0.027298850574712645

Year

2023 0.16461872063606794 2024 0.43910372244307916 2025 1.0 2026 0.46801590169859053 2027 0.0

Keywords

target 1.0 potential 0.29744799485309886 docking 0.22882264636500108 analysis 0.2092000857816856 visualization 0.19912073772249625 between 0.14615054685824577 novel 0.10100793480591894 energy 0.08074201158052756 promising 0.07731074415612267 binding 0.07570233755093288 cell 0.06455071842161698 activity 0.06187004074630067 stability 0.03881621273858031 synthesized 0.03345485738794767 performance 0.03173922367574523 interaction 0.027021230967188507 including 0.02251769247265709 development 0.02144542140253056 mechanism 0.021338194295517907 experimental 0.020909285867467296 effective 0.019408106369290155 protein 0.011902208878404461 synthesis 0.009650439631138753 enhanced 0.0025734505683036673 design 0.0
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