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Application

Discovery Studio 1.0 Materials Studio 0.9114031369224248 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05743424584004294 Amorphous Cell 0.27375201288244766 Blends 0.0021470746108427268 CASTEP 0.2882447665056361 CDOCKER 0.18089103596349973 CHARMm 0.2898550724637681 COMPASS 0.3333333333333333 COMPASS III 0.1111111111111111 COSMObase 0.004830917874396135 COSMOconf 0.00322061191626409 COSMOperm 0.0010735373054213634 COSMOplex 5.367686527106817E-4 COSMOquick 0.0010735373054213634 COSMOtherm 0.057971014492753624 Catalyst 0.08105206655931294 Classical Simulations 1.0 Conformers 5.367686527106817E-4 Crystallization 0.07407407407407407 DFTB Plus 0.003757380568974772 DMol3 0.14170692431561996 DPD 0.001610305958132045 Discover 0.0026838432635534087 Forcite 0.5131508319914116 GULP 0.011808910359634998 LUDI 0.0021470746108427268 LibDock 0.0762211486849168 LigandFit 0.0042941492216854536 MODELER 0.2549651100375738 Mesocite 0.003757380568974772 Mesoscale 0.005367686527106817 Morphology 0.017713365539452495 ONETEP 0.0 Polymorph 0.00322061191626409 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.42297369833601717 Reflex 0.05206655931293613 Reflex Plus 0.0010735373054213634 Semi-empirical 0.005367686527106817 Sorption 0.059044551798174985 Synthia 5.367686527106817E-4 VAMP 5.367686527106817E-4 Visualization 0.7112184648416533 X-Cell 0.0021470746108427268 ZDOCK 0.030595813204508857

Year

2024 0.0 2025 1.0 2026 0.8603138155376961

Keywords

target 1.0 potential 0.34237762237762237 docking 0.2523076923076923 analysis 0.23748251748251747 visualization 0.1806993006993007 between 0.13426573426573427 promising 0.11356643356643356 novel 0.10433566433566434 binding 0.08923076923076922 energy 0.06769230769230769 cell 0.06181818181818182 activity 0.06153846153846154 stability 0.05174825174825175 strong 0.04363636363636364 including 0.0386013986013986 performance 0.03496503496503497 mechanism 0.024335664335664337 therapeutic 0.023776223776223775 enhanced 0.023496503496503496 development 0.022377622377622378 effective 0.017342657342657344 strategy 0.013146853146853148 experimental 0.004755244755244755 synthesized 0.004755244755244755 protein 0.0
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