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Application

Discovery Studio 1.0 Materials Studio 0.9265323257766582 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07815275310834814 Amorphous Cell 0.2599171107164002 Blends 0.002960331557134399 CASTEP 0.40201302545885137 CDOCKER 0.1699230313795145 CHARMm 0.28656009473060984 COMPASS 0.37951450562462996 COMPASS III 0.04322084073416223 COSMObase 0.0 COSMOmic 5.920663114268798E-4 COSMOperm 0.0017761989342806395 COSMOplex 0.0 COSMOquick 5.920663114268798E-4 COSMOtherm 0.053878034339846066 Catalyst 0.11249259917110717 Classical Simulations 1.0 Conformers 0.002368265245707519 Crystallization 0.07874481941977501 DFTB Plus 0.003552397868561279 DMol3 0.18946121965660154 DPD 0.0041444641799881585 Discover 0.0017761989342806395 Forcite 0.5156897572528123 GULP 0.03315571343990527 Kinetix 0.0 LUDI 0.0041444641799881585 LibDock 0.07519242155121374 LigandFit 0.004736530491415038 MCSS 0.0017761989342806395 MODELER 0.27116637063351096 MesoDyn 0.003552397868561279 Mesocite 0.003552397868561279 Mesoscale 0.010657193605683837 Morphology 0.015393724097098875 ONETEP 5.920663114268798E-4 Polymorph 0.0 QMERA 0.0 Quantum Mechanics 0.5802249851983422 Reflex 0.06216696269982238 Semi-empirical 0.005920663114268798 Sorption 0.047365304914150384 Synthia 0.0 TURBOMOLE 5.920663114268798E-4 VAMP 0.0011841326228537595 Visualization 0.8312611012433393 ZDOCK 0.03197158081705151

Year

2024 0.0

Keywords

target 1.0 potential 0.2934624697336562 docking 0.2324455205811138 analysis 0.1973365617433414 visualization 0.1893462469733656 between 0.1595641646489104 novel 0.10871670702179177 binding 0.08934624697336561 energy 0.08014527845036319 activity 0.05447941888619855 interaction 0.05423728813559322 cell 0.049394673123486686 promising 0.048184019370460046 stability 0.038256658595641646 effective 0.03656174334140436 protein 0.03486682808716707 synthesized 0.029055690072639227 including 0.02784503631961259 mechanism 0.027360774818401937 synthesis 0.023728813559322035 experimental 0.022760290556900726 development 0.019612590799031476 higher 0.00774818401937046 compound 0.0070217917675544795 well 0.0
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