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Application

Discovery Studio 0.8531958003315527 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06289017341040462 Amorphous Cell 0.2910982658959538 Blends 0.0023121387283236996 CASTEP 0.33664739884393063 CDOCKER 0.15190751445086706 CHARMm 0.24508670520231213 COMPASS 0.34797687861271676 COMPASS III 0.1107514450867052 COSMObase 0.0055491329479768784 COSMOconf 0.006473988439306359 COSMOmic 0.0 COSMOperm 4.6242774566473987E-4 COSMOplex 2.3121387283236994E-4 COSMOquick 0.0011560693641618498 COSMOtherm 0.06890173410404624 Catalyst 0.06867052023121387 Classical Simulations 1.0 Conformers 4.6242774566473987E-4 Crystallization 0.07421965317919076 DFTB Plus 0.003005780346820809 DMol3 0.15676300578034683 DPD 0.0025433526011560694 Discover 0.004624277456647399 Forcite 0.5440462427745665 GULP 0.018034682080924857 Kinetix 2.3121387283236994E-4 LUDI 0.003930635838150289 LibDock 0.06358381502890173 LigandFit 0.0032369942196531793 MCSS 0.0 MODELER 0.2291329479768786 MesoDyn 6.936416184971098E-4 Mesocite 0.0032369942196531793 Mesoscale 0.006242774566473989 Morphology 0.016416184971098265 ONETEP 9.248554913294797E-4 Polymorph 0.0020809248554913293 QMERA 2.3121387283236994E-4 QSAR 6.936416184971098E-4 Quantum Mechanics 0.48393063583815027 Reflex 0.05410404624277457 Reflex Plus 6.936416184971098E-4 Semi-empirical 0.004624277456647399 Sorption 0.058034682080924854 Synthia 0.0011560693641618498 TURBOMOLE 0.0 VAMP 9.248554913294797E-4 Visualization 0.63121387283237 X-Cell 0.0016184971098265897 ZDOCK 0.024971098265895955

Year

2024 0.24857824252430746 2025 1.0 2026 0.7627958172812328 2027 0.0

Keywords

target 1.0 potential 0.2945955492758742 analysis 0.2088778994466031 docking 0.19368892028729542 between 0.14647356646650184 visualization 0.14058636524196397 energy 0.0839514894619098 novel 0.08336276933945602 promising 0.082891793241493 cell 0.06581890969033322 binding 0.05934298834334158 performance 0.05227834687389615 stability 0.042505592841163314 activity 0.03143765453903214 including 0.01942776404097492 enhanced 0.017190627575650534 strong 0.014718003061344636 experimental 0.014011538914400094 effective 0.013540562816437066 synthesized 0.010243730130695867 development 0.009066289885788297 mechanism 0.008830801836806783 strategy 0.0043565289061580125 design 0.0017661603673613563 interaction 0.0
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