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Application

Discovery Studio 0.8201168201168201 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06618421052631579 Amorphous Cell 0.29026315789473683 Blends 0.0025 CASTEP 0.3836842105263158 CDOCKER 0.14355263157894738 CHARMm 0.2330263157894737 COMPASS 0.3656578947368421 COMPASS III 0.09644736842105263 COSMObase 0.0043421052631578945 COSMOconf 0.005263157894736842 COSMOmic 1.3157894736842105E-4 COSMOperm 0.0013157894736842105 COSMOplex 1.3157894736842105E-4 COSMOquick 0.0014473684210526317 COSMOtherm 0.06618421052631579 Cantera 0.0 Catalyst 0.085 Classical Simulations 1.0 Conformers 7.894736842105263E-4 Crystallization 0.07328947368421053 DFTB Plus 0.005263157894736842 DMol3 0.17289473684210527 DPD 0.002368421052631579 Discover 0.0036842105263157894 Forcite 0.5576315789473684 GULP 0.021842105263157895 Kinetix 2.631578947368421E-4 LUDI 0.0030263157894736843 LibDock 0.06184210526315789 LigandFit 0.0036842105263157894 MCSS 3.9473684210526315E-4 MODELER 0.21552631578947368 MesoDyn 7.894736842105263E-4 Mesocite 0.003157894736842105 Mesoscale 0.0059210526315789476 Modules 0.0 Morphology 0.017105263157894738 ONETEP 0.0011842105263157896 Polymorph 0.001973684210526316 QMERA 1.3157894736842105E-4 QSAR 9.210526315789473E-4 Quantum Mechanics 0.5453947368421053 Reflex 0.053157894736842105 Reflex Plus 0.0011842105263157896 Semi-empirical 0.006842105263157895 Sorption 0.05868421052631579 Synthia 0.0013157894736842105 TURBOMOLE 3.9473684210526315E-4 VAMP 0.0011842105263157896 Visualization 0.6731578947368421 X-Cell 0.0015789473684210526 ZDOCK 0.024473684210526314

Year

2023 0.057740026722657 2024 0.43710631799961824 2025 1.0 2026 0.40561175796907806 2027 0.0

Keywords

target 1.0 potential 0.2853107344632768 analysis 0.19830508474576272 docking 0.18888888888888888 between 0.16020087884494663 visualization 0.15662272441933459 energy 0.09974890144381669 novel 0.09554300062774639 promising 0.07401129943502825 cell 0.0696798493408663 binding 0.05806654111738858 performance 0.04971751412429379 stability 0.04262397991211551 activity 0.03967357187696171 experimental 0.029315756434400504 including 0.022410546139359697 synthesized 0.02197112366603892 interaction 0.02102950408035154 effective 0.019648462021343377 mechanism 0.017953546767106088 development 0.016446955430006276 enhanced 0.01180163214061519 design 0.0022598870056497176 strong 1.8832391713747646E-4 synthesis 0.0
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