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Application

Discovery Studio 0.9838735177865613 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06861471861471861 Amorphous Cell 0.2663419913419913 Antibody 3.246753246753247E-4 Blends 0.0031385281385281384 CASTEP 0.44242424242424244 CDOCKER 0.18685064935064935 CHARMm 0.2676406926406926 COMPASS 0.3765151515151515 COMPASS III 0.05817099567099567 COSMObase 0.0022727272727272726 COSMOconf 0.00275974025974026 COSMOmic 3.246753246753247E-4 COSMOperm 0.001406926406926407 COSMOplex 4.87012987012987E-4 COSMOquick 0.0016774891774891775 COSMOtherm 0.06726190476190476 Cantera 5.411255411255411E-5 Catalyst 0.14637445887445888 Classical Simulations 1.0 Conformers 0.0016774891774891775 Crystallization 0.07932900432900433 DFTB Plus 0.006222943722943723 DMol3 0.2096861471861472 DPD 0.004058441558441558 Discover 0.007521645021645021 Forcite 0.514448051948052 GULP 0.031114718614718616 Kinetix 1.6233766233766234E-4 LUDI 0.007738095238095238 LibDock 0.07115800865800866 LigandFit 0.014285714285714285 MCSS 0.0017857142857142857 MODELER 0.2259199134199134 MesoDyn 0.0022186147186147188 Mesocite 0.005357142857142857 Mesoscale 0.009902597402597402 Modules 0.0 Morphology 0.019209956709956708 ONETEP 0.0017316017316017316 Polymorph 0.0021645021645021645 QMERA 4.87012987012987E-4 QSAR 0.0017857142857142857 Quantum Mechanics 0.6382575757575758 Reflex 0.05800865800865801 Reflex Plus 0.0010281385281385282 Reflex QPA 0.0 Semi-empirical 0.0091991341991342 Sorption 0.05216450216450216 Synthia 0.0012987012987012987 TURBOMOLE 7.575757575757576E-4 VAMP 0.002380952380952381 Visualization 0.832521645021645 X-Cell 0.0012445887445887446 ZDOCK 0.03079004329004329

Year

2015 0.00937658388241257 2016 0.060821084642676125 2017 0.07002872106774793 2018 0.08126372698090893 2019 0.1270484879202568 2020 0.20670721405642845 2021 0.328856225713803 2022 0.5161344821760433 2023 0.8253083291096469 2024 1.0 2025 0.9662105085318466 2026 0.3590978205778003 2027 0.0

Keywords

target 1.0 potential 0.21943419434194342 visualization 0.18591076819859106 docking 0.18459130045845912 between 0.15144805993514482 analysis 0.1502180476350218 novel 0.09272056356927205 energy 0.07643967348764397 binding 0.05877222408587722 cell 0.05087778150508778 activity 0.049647769204964776 interaction 0.03685564128368556 experimental 0.02996757240299676 promising 0.025830258302583026 synthesized 0.02363860002236386 mechanism 0.01768981326176898 protein 0.014245778821424578 stability 0.008207536620820754 synthesis 0.006284244660628425 development 0.005792239740579224 chemical 0.005456781840545678 effective 0.0024600246002460025 performance 8.945544000894555E-4 design 7.827351000782735E-4 well 0.0
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