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Application

Discovery Studio 0.8731631863882444 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0701926216127979 Amorphous Cell 0.2853411687887692 Blends 0.001632386549134835 CASTEP 0.356839699640875 CDOCKER 0.15899444988573294 CHARMm 0.25301991511589944 COMPASS 0.3604309500489716 COMPASS III 0.089128305582762 COSMObase 0.0035912504080966375 COSMOconf 0.006203068886712374 COSMOperm 6.52954619653934E-4 COSMOquick 0.0019588638589618022 COSMOtherm 0.06986614430297095 Catalyst 0.0701926216127979 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07117205354227882 DFTB Plus 0.0075089781260202415 DMol3 0.1593209271955599 DPD 0.00326477309826967 Discover 0.00326477309826967 Forcite 0.5497877897486124 GULP 0.02187397975840679 Kinetix 0.0 LUDI 0.0035912504080966375 LibDock 0.06594841658504734 LigandFit 0.00326477309826967 MODELER 0.24681684622918706 MesoDyn 0.001305909239307868 Mesocite 0.001632386549134835 Mesoscale 0.006203068886712374 Modules 0.0 Morphology 0.017956252040483185 ONETEP 6.52954619653934E-4 Polymorph 0.001305909239307868 QSAR 0.001305909239307868 Quantum Mechanics 0.5053868756121449 Reflex 0.05027750571335292 Reflex Plus 0.001305909239307868 Semi-empirical 0.009141364675155077 Sorption 0.053542278811622594 Synthia 0.001632386549134835 TURBOMOLE 3.26477309826967E-4 VAMP 0.001305909239307868 Visualization 0.643486777668952 X-Cell 0.0019588638589618022 ZDOCK 0.02644466209598433

Year

2025 0.0

Keywords

target 1.0 potential 0.3036144578313253 analysis 0.2016566265060241 docking 0.19216867469879517 between 0.15768072289156626 visualization 0.138855421686747 novel 0.09367469879518073 energy 0.08870481927710844 promising 0.08539156626506024 binding 0.07153614457831325 cell 0.06671686746987952 stability 0.04653614457831325 including 0.04246987951807229 activity 0.041867469879518074 performance 0.03599397590361446 experimental 0.026204819277108434 development 0.024096385542168676 interaction 0.023493975903614458 strong 0.0213855421686747 effective 0.01746987951807229 synthesized 0.016566265060240965 enhanced 0.013403614457831326 mechanism 0.009939759036144578 synthesis 1.5060240963855423E-4 therapeutic 0.0
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