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Application

Discovery Studio 0.9158152840212506 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06947871070433745 Amorphous Cell 0.2828491842419419 Blends 0.002626343016315161 CASTEP 0.4181456426581775 CDOCKER 0.16211699164345403 CHARMm 0.24257859132510942 COMPASS 0.37922801432550735 COMPASS III 0.07560684440907282 COSMObase 0.003024273776362913 COSMOconf 0.0034222045364106645 COSMOmic 2.38758456028651E-4 COSMOperm 0.0013529645841623558 COSMOplex 3.979307600477517E-4 COSMOquick 0.001432550736171906 COSMOtherm 0.06462395543175488 Cantera 7.958615200955034E-5 Catalyst 0.11659371269399124 Classical Simulations 1.0 Conformers 0.0011142061281337048 Crystallization 0.07680063668921608 DFTB Plus 0.006207719856744926 DMol3 0.19251890171110228 DPD 0.003103859928372463 Discover 0.00461599681655392 Forcite 0.543891762833267 GULP 0.027536808595304416 Kinetix 2.38758456028651E-4 LUDI 0.00461599681655392 LibDock 0.06717071229606049 LigandFit 0.006526064464783128 MCSS 9.55033824114604E-4 MODELER 0.17397532829287704 MesoDyn 0.0015917230401910067 Mesocite 0.0040588937524870675 Mesoscale 0.007640270592916832 Modules 0.0 Morphology 0.018066056506167927 ONETEP 0.001193792280143255 Polymorph 0.001910067648229208 QMERA 2.38758456028651E-4 QSAR 0.0013529645841623558 Quantum Mechanics 0.5980899323517708 Reflex 0.05658575407879029 Reflex Plus 7.16275368085953E-4 Semi-empirical 0.008436132113012336 Sorption 0.05690409868682849 Synthia 0.0015121368881814564 TURBOMOLE 5.571030640668524E-4 VAMP 0.0018304814962196577 Visualization 0.8148826104257859 X-Cell 0.001193792280143255 ZDOCK 0.02841225626740947

Year

2020 0.0 2021 0.09805808257522743 2022 0.21938418474457663 2023 0.4511021693491952 2024 0.9474282715185445 2025 1.0 2026 0.3727256822953114 2027 8.747375787263821E-4

Keywords

target 1.0 potential 0.25910735826296744 docking 0.20010339479579528 visualization 0.19476133034637258 analysis 0.17752886438049284 between 0.1554713079441668 novel 0.09512321213165605 energy 0.09084956057211788 binding 0.061830087885576424 cell 0.06048595554023781 promising 0.04635533344821644 activity 0.04490780630708254 interaction 0.03691194209891435 experimental 0.0314320179217646 stability 0.03053592969153886 synthesized 0.02605548854041013 performance 0.0242977770118904 mechanism 0.018679993107013612 effective 0.016681027054971567 development 0.014716525934861278 protein 0.011063243150094779 including 0.009477856281233845 synthesis 0.00913320696191625 chemical 0.0025159400310184386 design 0.0
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