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Application

Discovery Studio 0.9965989286625287 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0641729196998544 Amorphous Cell 0.2824504423787658 Blends 0.0024638817336767836 CASTEP 0.39959681935267105 CDOCKER 0.17269571060589092 CHARMm 0.2555717325568373 COMPASS 0.3675663568148729 COMPASS III 0.0852279090603651 COSMObase 0.0036958226005151754 COSMOconf 0.004367790346063389 COSMOmic 1.1199462425803562E-4 COSMOperm 0.0012319408668383918 COSMOplex 3.359838727741068E-4 COSMOquick 0.0012319408668383918 COSMOtherm 0.06708477993056333 Cantera 0.0 Catalyst 0.11154664576100347 Classical Simulations 1.0 Conformers 7.839623698062493E-4 Crystallization 0.07369246276178744 DFTB Plus 0.006047709709933923 DMol3 0.18266323216485608 DPD 0.0027998656064508903 Discover 0.0048157688430955315 Forcite 0.5329824168439915 GULP 0.02575876357934819 Kinetix 2.2398924851607123E-4 LUDI 0.004927763467353567 LibDock 0.07134057565236869 LigandFit 0.006719677455482137 MCSS 0.0010079516183223206 MODELER 0.20607010863478553 MesoDyn 0.0013439354910964273 Mesocite 0.0036958226005151754 Mesoscale 0.006943666703998208 Modules 0.0 Morphology 0.017807145257027663 ONETEP 7.839623698062493E-4 Polymorph 0.0022398924851607122 QMERA 2.2398924851607123E-4 QSAR 0.0013439354910964273 Quantum Mechanics 0.5697166536006272 Reflex 0.053197446522566916 Reflex Plus 7.839623698062493E-4 Semi-empirical 0.0081756075708366 Sorption 0.05521334975921156 Synthia 0.0019039086123866053 TURBOMOLE 3.359838727741068E-4 VAMP 0.0016799193638705342 Visualization 0.836599843207526 X-Cell 0.0010079516183223206 ZDOCK 0.030014559301153546

Year

2020 0.0 2021 0.15183491616836675 2022 0.20189940204009849 2023 0.3016766326650252 2024 0.812756477898933 2025 1.0 2026 0.4946652597021925 2027 2.3449407902450463E-4

Keywords

target 1.0 potential 0.27051804423748543 docking 0.21434807916181606 visualization 0.20057237097400077 analysis 0.18553550640279395 between 0.1510477299185099 novel 0.0992918121847109 energy 0.08406092355452076 binding 0.06844198680636399 cell 0.06111757857974389 promising 0.05505432673651533 activity 0.05107683352735739 interaction 0.03206247574699263 stability 0.029297632906480405 experimental 0.02871556072953046 synthesized 0.028230500582072177 performance 0.022021730694606133 development 0.019062863795110595 effective 0.0163465269693442 mechanism 0.015812960807140085 protein 0.014454792394256889 including 0.012272021730694607 synthesis 0.00892510671323244 design 0.0018917345750873108 chemical 0.0
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