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Application

Discovery Studio 1.0 Materials Studio 0.9975305432804783 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060650406504065044 Amorphous Cell 0.284390243902439 Blends 0.001951219512195122 CASTEP 0.3456910569105691 CDOCKER 0.16455284552845528 CHARMm 0.26097560975609757 COMPASS 0.348780487804878 COMPASS III 0.10130081300813008 COSMObase 0.004390243902439025 COSMOconf 0.005691056910569106 COSMOmic 1.6260162601626016E-4 COSMOperm 0.0011382113821138211 COSMOplex 1.6260162601626016E-4 COSMOquick 0.0013008130081300813 COSMOtherm 0.0656910569105691 Catalyst 0.09252032520325203 Classical Simulations 1.0 Conformers 3.252032520325203E-4 Crystallization 0.07170731707317073 DFTB Plus 0.004390243902439025 DMol3 0.15902439024390244 DPD 0.0022764227642276423 Discover 0.003902439024390244 Forcite 0.5346341463414634 GULP 0.02032520325203252 Kinetix 1.6260162601626016E-4 LUDI 0.0035772357723577236 LibDock 0.0702439024390244 LigandFit 0.0040650406504065045 MCSS 3.252032520325203E-4 MODELER 0.23804878048780487 MesoDyn 6.504065040650406E-4 Mesocite 0.0024390243902439024 Mesoscale 0.005203252032520325 Modules 0.0 Morphology 0.017398373983739838 ONETEP 8.130081300813008E-4 Polymorph 0.001951219512195122 QMERA 1.6260162601626016E-4 QSAR 8.130081300813008E-4 Quantum Mechanics 0.4943089430894309 Reflex 0.05154471544715447 Reflex Plus 0.0011382113821138211 Semi-empirical 0.0060162601626016264 Sorption 0.0583739837398374 Synthia 0.0016260162601626016 TURBOMOLE 1.6260162601626016E-4 VAMP 0.0011382113821138211 Visualization 0.7551219512195122 X-Cell 0.0014634146341463415 ZDOCK 0.028943089430894308

Year

2023 0.09831068207798806 2024 0.4704686904610695 2025 1.0 2026 0.5377873745713198 2027 0.0

Keywords

target 1.0 potential 0.29707364778454826 docking 0.21853607161664035 analysis 0.2082298954336869 visualization 0.1803204694199955 between 0.14932671330775596 novel 0.0981719702098849 energy 0.08064394794252615 promising 0.07688256977356503 binding 0.07026254419619349 cell 0.06431956668923494 activity 0.0526592943654555 stability 0.037613781689611075 performance 0.03415331377416685 synthesized 0.02128940043631987 including 0.019483938915218536 experimental 0.018957345971563982 interaction 0.01858120815466787 development 0.017001429323704204 effective 0.016625291506808096 mechanism 0.015647333182878205 protein 0.005867749943579328 enhanced 0.005190701873166328 strong 4.513653802753329E-4 synthesis 0.0
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