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Application

Discovery Studio 0.9369822795428332 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06816292601828762 Amorphous Cell 0.28470490440565255 Blends 0.0023552230534774174 CASTEP 0.39179828207259626 CDOCKER 0.16458852867830423 CHARMm 0.24785259074535881 COMPASS 0.3676918814075921 COMPASS III 0.08326406206705458 COSMObase 0.003463563313937379 COSMOconf 0.004987531172069825 COSMOmic 1.3854253255749516E-4 COSMOperm 0.0012468827930174563 COSMOplex 4.1562759767248546E-4 COSMOquick 8.312551953449709E-4 COSMOtherm 0.06663895816015517 Cantera 0.0 Catalyst 0.114159046827376 Classical Simulations 1.0 Conformers 6.927126627874758E-4 Crystallization 0.07605985037406483 DFTB Plus 0.006234413965087282 DMol3 0.17636464394569132 DPD 0.003047935716264893 Discover 0.004017733444167359 Forcite 0.5448877805486284 GULP 0.021612635078969242 Kinetix 2.770850651149903E-4 LUDI 0.00457190357439734 LibDock 0.06677750069271267 LigandFit 0.005541701302299806 MCSS 4.1562759767248546E-4 MODELER 0.18772513161540594 MesoDyn 8.312551953449709E-4 Mesocite 0.0038791909116098642 Mesoscale 0.006927126627874758 Morphology 0.017871986699916874 ONETEP 0.0012468827930174563 Polymorph 0.0022166805209199226 QMERA 2.770850651149903E-4 QSAR 9.697977279024661E-4 Quantum Mechanics 0.5588805763369354 Reflex 0.05513992795788307 Reflex Plus 5.541701302299807E-4 Semi-empirical 0.008174009420892215 Sorption 0.056802438348573014 Synthia 0.0012468827930174563 TURBOMOLE 5.541701302299807E-4 VAMP 0.0013854253255749516 Visualization 0.784566361873095 X-Cell 0.0013854253255749516 ZDOCK 0.029371016902188973

Year

2022 0.14502193273959857 2023 0.2853914661704107 2024 0.6942709025654659 2025 1.0 2026 0.520802871195002 2027 0.0

Keywords

target 1.0 potential 0.2777812247936961 docking 0.21021281876279704 analysis 0.194763293416889 visualization 0.1896754979214494 between 0.15275795743624743 novel 0.09654402184029286 energy 0.08891232859713347 binding 0.06949184091332133 cell 0.06614134144071478 promising 0.061549916237513186 activity 0.05168455667928275 stability 0.039151206800273 performance 0.032077930135881366 experimental 0.030402680399578084 synthesized 0.02903766209592356 interaction 0.028479245517155798 effective 0.021778246571942668 mechanism 0.020413228268288144 including 0.018800024818514612 development 0.016504312216913817 synthesis 0.010175590990879196 protein 0.008748526400694918 design 0.0033504994726065644 chemical 0.0
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